[2-[cyanomethyl(phenyl)amino]-2-oxidanylidene-ethyl] (E)-3-(6-methoxynaphthalen-2-yl)prop-2-enoate

Systemtic Name: [2-[cyanomethyl(phenyl)amino]-2-oxidanylidene-ethyl] (E)-3-(6-methoxynaphthalen-2-yl)prop-2-enoate Openeye Name: [2-[N-(cyanomethyl)anilino]-2-oxo-ethyl] (E)-3-(6-methoxy-2-naphthyl)prop-2-enoate CAS Name: (E)-3-(6-methoxy-2-naphthalenyl)-2-propenoic acid [2-[N-(cyanomethyl)anilino]-2-oxoethyl] ester IUPAC Name: [2-[N-(cyanomethyl)anilino]-2-oxoethyl] (E)-3-(6-methoxynaphthalen-2-yl)prop-2-enoate Traditional Name: (E)-3-(6-methoxy-2-naphthyl)acrylic acid [2-[N-(cyanomethyl)anilino]-2-keto-ethyl] ester Formula: C24H20N2O4 MolecularWeight: 400.4266

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=C(C=C2)C=CC(=O)OCC(=O)N(CC#N)C3=CC=CC=C3

Isomeric SMILES

COC1=CC2=C(C=C1)C=C(C=C2)/C=C/C(=O)OCC(=O)N(CC#N)C3=CC=CC=C3

InChI

InChI=1S/C24H20N2O4/c1-29-22-11-10-19-15-18(7-9-20(19)16-22)8-12-24(28)30-17-23(27)26(14-13-25)21-5-3-2-4-6-21/h2-12,15-16H,14,17H2,1H3/b12-8+