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Formula of 2-[(1R)-2-amino-1-(2-methoxyphenoxy)ethyl]-1-methoxy-4-methylbenzene (C17H21NO3)

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2D chemical structure image of 2-[(1R)-2-amino-1-(2-methoxyphenoxy)ethyl]-1-methoxy-4-methylbenzene
Chemical Formula C17H21NO3
Molecular Weight 287.35354 g/mol
IUPAC Name 2-[(1R)-2-amino-1-(2-methoxyphenoxy)ethyl]-1-methoxy-4-methylbenzene
SMILES String COc1ccccc1OC(CN)c2cc(C)ccc2OC
InChI InChI=1S/C17H21NO3/c1-12-8-9-14(19-2)13(10-12)17(11-18)21-16-7-5-4-6-15(16)20-3/h4-10,17H,11,18H2,1-3H3/t17-/m0/s1
InChIKey POKXWYRSDZRGQA-KRWDZBQOSA-N
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Chemical Formula Description

The 2-[(1R)-2-amino-1-(2-methoxyphenoxy)ethyl]-1-methoxy-4-methylbenzene molecule contains a total of 42 atom(s). There are 21 Hydrogen atom(s), 17 Carbon atom(s), 1 Nitrogen atom(s), and 3 Oxygen atom(s). A chemical formula of 2-[(1R)-2-amino-1-(2-methoxyphenoxy)ethyl]-1-methoxy-4-methylbenzene can therefore be written as:

C17H21NO3

The chemical formula of 2-[(1R)-2-amino-1-(2-methoxyphenoxy)ethyl]-1-methoxy-4-methylbenzene shown above is based on the molecular formula indicating the numbers of each type of atom in a molecule without structural information, which is different from the empirical formula which provides the numerical proportions of atoms of each type.

The above chemical formula is the basis of stoichiometry in chemical equations, i.e., the calculation of relative quantities of reactants and products in chemical reactions. The law of conservation of mass dictates that the quantity of each element given in the chemical formula does not change in a chemical reaction. Thus, each side of the chemical equation must represent the same quantity of any particular element based on the chemical formula.

3D chemical structure image of 2-[(1R)-2-amino-1-(2-methoxyphenoxy)ethyl]-1-methoxy-4-methylbenzene
Ball-and-stick model of 2-[(1R)-2-amino-1-(2-methoxyphenoxy)ethyl]-1-methoxy-4-methylbenzene

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  • Name: ethanol
  • CAS #: 64-17-5
  • Formula: C2H5OH
  • Smiles: CCO
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Additional Information for Identifying 2-[(1R)-2-amino-1-(2-methoxyphenoxy)ethyl]-1-methoxy-4-methylbenzene Molecule


  • InChI (IUPAC International Chemical Identifier) information of 2-[(1R)-2-amino-1-(2-methoxyphenoxy)ethyl]-1-methoxy-4-methylbenzene

    The molecular chemical formulas lack structural information. An alternative textual expression including the structural information is InChI. The full standard InChI of 2-[(1R)-2-amino-1-(2-methoxyphenoxy)ethyl]-1-methoxy-4-methylbenzene is:

    InChI=1S/C17H21NO3/c1-12-8-9-14(19-2)13(10-12)17(11-18)21-16-7-5-4-6-15(16)20-3/h4-10,17H,11,18H2,1-3H3/t17-/m0/s1

    It can provide a standard way to encode the molecular information of 2-[(1R)-2-amino-1-(2-methoxyphenoxy)ethyl]-1-methoxy-4-methylbenzene to facilitate the search for the compound information in databases and on the web.

    The condensed, 27 character standard InChIKey (hashed version of the full standard InChI) of 2-[(1R)-2-amino-1-(2-methoxyphenoxy)ethyl]-1-methoxy-4-methylbenzene is:

    InChIKey=POKXWYRSDZRGQA-KRWDZBQOSA-N

    The InChIKey may allow easier web searches for 2-[(1R)-2-amino-1-(2-methoxyphenoxy)ethyl]-1-methoxy-4-methylbenzene, but it needs to be linked to the full InChI to get back to the original structure of the 2-[(1R)-2-amino-1-(2-methoxyphenoxy)ethyl]-1-methoxy-4-methylbenzene since the full standard InChI cannot be reconstructed from the InChIKey.

  • Other names (synonyms) or registry numbers of 2-[(1R)-2-amino-1-(2-methoxyphenoxy)ethyl]-1-methoxy-4-methylbenzene

    The 2-[(1R)-2-amino-1-(2-methoxyphenoxy)ethyl]-1-methoxy-4-methylbenzene compound may have different names depending on the various different situations of industrial applications. The list of the other names (synonyms) of 2-[(1R)-2-amino-1-(2-methoxyphenoxy)ethyl]-1-methoxy-4-methylbenzene including the registry numbers is given below, if available:



    None available.


2-[(1R)-2-amino-1-(2-methoxyphenoxy)ethyl]-1-methoxy-4-methylbenzene Identification Summary Frequently Asked Questions (FAQs)

What’s the chemical formula of 2-[(1R)-2-amino-1-(2-methoxyphenoxy)ethyl]-1-methoxy-4-methylbenzene?
C17H21NO3
How many atoms and what are they in the 2-[(1R)-2-amino-1-(2-methoxyphenoxy)ethyl]-1-methoxy-4-methylbenzene structure?
42 atom(s) - 21 Hydrogen atom(s), 17 Carbon atom(s), 1 Nitrogen atom(s), and 3 Oxygen atom(s)
How many chemical bonds and what are they in the 2-[(1R)-2-amino-1-(2-methoxyphenoxy)ethyl]-1-methoxy-4-methylbenzene structure?
43 bond(s) - 22 non-H bond(s), 12 multiple bond(s), 6 rotatable bond(s), 12 aromatic bond(s), 2 six-membered ring(s), 1 primary amine(s) (aliphatic), and 3 ether(s) (aromatic)
What’s the molecular weight of 2-[(1R)-2-amino-1-(2-methoxyphenoxy)ethyl]-1-methoxy-4-methylbenzene?
287.35354 g/mol
What’s the SMILES string of 2-[(1R)-2-amino-1-(2-methoxyphenoxy)ethyl]-1-methoxy-4-methylbenzene?
COc1ccccc1OC(CN)c2cc(C)ccc2OC
What’s the InChI of 2-[(1R)-2-amino-1-(2-methoxyphenoxy)ethyl]-1-methoxy-4-methylbenzene?
InChI=1S/C17H21NO3/c1-12-8-9-14(19-2)13(10-12)17(11-18)21-16-7-5-4-6-15(16)20-3/h4-10,17H,11,18H2,1-3H3/t17-/m0/s1
What’s the InChIKey of 2-[(1R)-2-amino-1-(2-methoxyphenoxy)ethyl]-1-methoxy-4-methylbenzene?
POKXWYRSDZRGQA-KRWDZBQOSA-N