[2-[2-(2-methylphenyl)ethylamino]-2-oxidanylidene-ethyl] (E)-3-(4-cyanophenyl)prop-2-enoate

Systemtic Name: [2-[2-(2-methylphenyl)ethylamino]-2-oxidanylidene-ethyl] (E)-3-(4-cyanophenyl)prop-2-enoate Openeye Name: [2-[2-(o-tolyl)ethylamino]-2-oxo-ethyl] (E)-3-(4-cyanophenyl)prop-2-enoate CAS Name: (E)-3-(4-cyanophenyl)-2-propenoic acid [2-[2-(2-methylphenyl)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(2-methylphenyl)ethylamino]-2-oxoethyl] (E)-3-(4-cyanophenyl)prop-2-enoate Traditional Name: (E)-3-(4-cyanophenyl)acrylic acid [2-keto-2-[2-(o-tolyl)ethylamino]ethyl] ester Formula: C21H20N2O3 MolecularWeight: 348.3951

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CCNC(=O)COC(=O)C=CC2=CC=C(C=C2)C#N

Isomeric SMILES

CC1=CC=CC=C1CCNC(=O)COC(=O)/C=C/C2=CC=C(C=C2)C#N

InChI

InChI=1S/C21H20N2O3/c1-16-4-2-3-5-19(16)12-13-23-20(24)15-26-21(25)11-10-17-6-8-18(14-22)9-7-17/h2-11H,12-13,15H2,1H3,(H,23,24)/b11-10+