methyl (2S)-2-azanyl-3-[4-(4-ethanoylphenyl)phenyl]propanoate hydrochloride

Systemtic Name: methyl (2S)-2-azanyl-3-[4-(4-ethanoylphenyl)phenyl]propanoate hydrochloride Openeye Name: methyl (2S)-3-[4-(4-acetylphenyl)phenyl]-2-amino-propanoate hydrochloride CAS Name: (2S)-3-[4-(4-acetylphenyl)phenyl]-2-aminopropanoic acid methyl ester hydrochloride IUPAC Name: methyl (2S)-3-[4-(4-acetylphenyl)phenyl]-2-aminopropanoate hydrochloride Traditional Name: (2S)-3-[4-(4-acetylphenyl)phenyl]-2-amino-propionic acid methyl ester hydrochloride Formula: C18H20ClNO3 MolecularWeight: 333.8093

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)CC(C(=O)OC)N.Cl

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)C[C@@H](C(=O)OC)N.Cl

InChI

InChI=1S/C18H19NO3.ClH/c1-12(20)14-7-9-16(10-8-14)15-5-3-13(4-6-15)11-17(19)18(21)22-2;/h3-10,17H,11,19H2,1-2H3;1H/t17-;/m0./s1