[2-oxidanylidene-2-[phenethyl-(phenylmethyl)amino]ethyl] (E)-3-(4-methylphenyl)prop-2-enoate

Systemtic Name: [2-oxidanylidene-2-[phenethyl-(phenylmethyl)amino]ethyl] (E)-3-(4-methylphenyl)prop-2-enoate Openeye Name: [2-[benzyl(phenethyl)amino]-2-oxo-ethyl] (E)-3-(p-tolyl)prop-2-enoate CAS Name: (E)-3-(4-methylphenyl)-2-propenoic acid [2-oxo-2-[phenethyl-(phenylmethyl)amino]ethyl] ester IUPAC Name: [2-[benzyl(phenethyl)amino]-2-oxoethyl] (E)-3-(4-methylphenyl)prop-2-enoate Traditional Name: (E)-3-(p-tolyl)acrylic acid [2-[benzyl(phenethyl)amino]-2-keto-ethyl] ester Formula: C27H27NO3 MolecularWeight: 413.50818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=CC(=O)OCC(=O)N(CCC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)/C=C/C(=O)OCC(=O)N(CCC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C27H27NO3/c1-22-12-14-24(15-13-22)16-17-27(30)31-21-26(29)28(20-25-10-6-3-7-11-25)19-18-23-8-4-2-5-9-23/h2-17H,18-21H2,1H3/b17-16+