methyl 2-azanyl-3-oxidanylidene-3-(4-phenylmethoxyphenyl)propanoate hydrochloride

Systemtic Name: methyl 2-azanyl-3-oxidanylidene-3-(4-phenylmethoxyphenyl)propanoate hydrochloride Openeye Name: methyl 2-amino-3-(4-benzyloxyphenyl)-3-oxo-propanoate hydrochloride CAS Name: 2-amino-3-oxo-3-(4-phenylmethoxyphenyl)propanoic acid methyl ester hydrochloride IUPAC Name: methyl 2-amino-3-oxo-3-(4-phenylmethoxyphenyl)propanoate hydrochloride Traditional Name: 2-amino-3-(4-benzoxyphenyl)-3-keto-propionic acid methyl ester hydrochloride Formula: C17H18ClNO4 MolecularWeight: 335.78212

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C(=O)C1=CC=C(C=C1)OCC2=CC=CC=C2)N.Cl

Isomeric SMILES

COC(=O)C(C(=O)C1=CC=C(C=C1)OCC2=CC=CC=C2)N.Cl

InChI

InChI=1S/C17H17NO4.ClH/c1-21-17(20)15(18)16(19)13-7-9-14(10-8-13)22-11-12-5-3-2-4-6-12;/h2-10,15H,11,18H2,1H3;1H