[3-[(E)-2-cyano-3-[(4-methoxy-2-methyl-phenyl)amino]-3-oxidanylidene-prop-1-enyl]phenyl] naphthalene-1-carboxylate

Systemtic Name: [3-[(E)-2-cyano-3-[(4-methoxy-2-methyl-phenyl)amino]-3-oxidanylidene-prop-1-enyl]phenyl] naphthalene-1-carboxylate Openeye Name: [3-[(E)-2-cyano-3-(4-methoxy-2-methyl-anilino)-3-oxo-prop-1-enyl]phenyl] naphthalene-1-carboxylate CAS Name: 1-naphthalenecarboxylic acid [3-[(E)-2-cyano-3-(4-methoxy-2-methylanilino)-3-oxoprop-1-enyl]phenyl] ester IUPAC Name: [3-[(E)-2-cyano-3-(4-methoxy-2-methylanilino)-3-oxoprop-1-enyl]phenyl] naphthalene-1-carboxylate Traditional Name: naphthalene-1-carboxylic acid [3-[(E)-2-cyano-3-keto-3-(4-methoxy-2-methyl-anilino)prop-1-enyl]phenyl] ester Formula: C29H22N2O4 MolecularWeight: 462.49598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC)NC(=O)C(=CC2=CC(=CC=C2)OC(=O)C3=CC=CC4=CC=CC=C43)C#N

Isomeric SMILES

CC1=C(C=CC(=C1)OC)NC(=O)/C(=C/C2=CC(=CC=C2)OC(=O)C3=CC=CC4=CC=CC=C43)/C#N

InChI

InChI=1S/C29H22N2O4/c1-19-15-23(34-2)13-14-27(19)31-28(32)22(18-30)16-20-7-5-10-24(17-20)35-29(33)26-12-6-9-21-8-3-4-11-25(21)26/h3-17H,1-2H3,(H,31,32)/b22-16+