[(1R)-2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl] 2-(3,4-dimethoxyphenyl)ethanoate

Systemtic Name: [(1R)-2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl] 2-(3,4-dimethoxyphenyl)ethanoate Openeye Name: [(1R)-2-(cyclopropylamino)-2-oxo-1-phenyl-ethyl] 2-(3,4-dimethoxyphenyl)acetate CAS Name: 2-(3,4-dimethoxyphenyl)acetic acid [(1R)-2-(cyclopropylamino)-2-oxo-1-phenylethyl] ester IUPAC Name: [(1R)-2-(cyclopropylamino)-2-oxo-1-phenylethyl] 2-(3,4-dimethoxyphenyl)acetate Traditional Name: 2-(3,4-dimethoxyphenyl)acetic acid [(1R)-2-(cyclopropylamino)-2-keto-1-phenyl-ethyl] ester Formula: C21H23NO5 MolecularWeight: 369.41102

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC(=O)OC(C2=CC=CC=C2)C(=O)NC3CC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC(=O)O[C@H](C2=CC=CC=C2)C(=O)NC3CC3)OC

InChI

InChI=1S/C21H23NO5/c1-25-17-11-8-14(12-18(17)26-2)13-19(23)27-20(15-6-4-3-5-7-15)21(24)22-16-9-10-16/h3-8,11-12,16,20H,9-10,13H2,1-2H3,(H,22,24)/t20-/m1/s1