[2-oxidanylidene-2-[phenethyl-(phenylmethyl)amino]ethyl] 2-(3,4-dimethoxyphenyl)ethanoate

Systemtic Name: [2-oxidanylidene-2-[phenethyl-(phenylmethyl)amino]ethyl] 2-(3,4-dimethoxyphenyl)ethanoate Openeye Name: [2-[benzyl(phenethyl)amino]-2-oxo-ethyl] 2-(3,4-dimethoxyphenyl)acetate CAS Name: 2-(3,4-dimethoxyphenyl)acetic acid [2-oxo-2-[phenethyl-(phenylmethyl)amino]ethyl] ester IUPAC Name: [2-[benzyl(phenethyl)amino]-2-oxoethyl] 2-(3,4-dimethoxyphenyl)acetate Traditional Name: 2-(3,4-dimethoxyphenyl)acetic acid [2-[benzyl(phenethyl)amino]-2-keto-ethyl] ester Formula: C27H29NO5 MolecularWeight: 447.52286

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC(=O)OCC(=O)N(CCC2=CC=CC=C2)CC3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC(=O)OCC(=O)N(CCC2=CC=CC=C2)CC3=CC=CC=C3)OC

InChI

InChI=1S/C27H29NO5/c1-31-24-14-13-23(17-25(24)32-2)18-27(30)33-20-26(29)28(19-22-11-7-4-8-12-22)16-15-21-9-5-3-6-10-21/h3-14,17H,15-16,18-20H2,1-2H3