[2-oxidanylidene-2-[phenethyl-(phenylmethyl)amino]ethyl] (E)-3-(3-methoxyphenyl)prop-2-enoate

Systemtic Name: [2-oxidanylidene-2-[phenethyl-(phenylmethyl)amino]ethyl] (E)-3-(3-methoxyphenyl)prop-2-enoate Openeye Name: [2-[benzyl(phenethyl)amino]-2-oxo-ethyl] (E)-3-(3-methoxyphenyl)prop-2-enoate CAS Name: (E)-3-(3-methoxyphenyl)-2-propenoic acid [2-oxo-2-[phenethyl-(phenylmethyl)amino]ethyl] ester IUPAC Name: [2-[benzyl(phenethyl)amino]-2-oxoethyl] (E)-3-(3-methoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(3-methoxyphenyl)acrylic acid [2-[benzyl(phenethyl)amino]-2-keto-ethyl] ester Formula: C27H27NO4 MolecularWeight: 429.50758

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H27NO4/c1-31-25-14-8-13-23(19-25)15-16-27(30)32-21-26(29)28(20-24-11-6-3-7-12-24)18-17-22-9-4-2-5-10-22/h2-16,19H,17-18,20-21H2,1H3/b16-15+