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

Systemtic Name: [4-[(E)-2-cyano-3-[(2-methoxycarbonylphenyl)amino]-3-oxidanylidene-prop-1-enyl]phenyl] naphthalene-1-carboxylate Openeye Name: [4-[(E)-2-cyano-3-(2-methoxycarbonylanilino)-3-oxo-prop-1-enyl]phenyl] naphthalene-1-carboxylate CAS Name: 1-naphthalenecarboxylic acid [4-[(E)-2-cyano-3-(2-methoxycarbonylanilino)-3-oxoprop-1-enyl]phenyl] ester IUPAC Name: [4-[(E)-2-cyano-3-(2-methoxycarbonylanilino)-3-oxoprop-1-enyl]phenyl] naphthalene-1-carboxylate Traditional Name: naphthalene-1-carboxylic acid [4-[(E)-3-(2-carbomethoxyanilino)-2-cyano-3-keto-prop-1-enyl]phenyl] ester Formula: C29H20N2O5 MolecularWeight: 476.4795

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)C(=CC2=CC=C(C=C2)OC(=O)C3=CC=CC4=CC=CC=C43)C#N

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)/C(=C/C2=CC=C(C=C2)OC(=O)C3=CC=CC4=CC=CC=C43)/C#N

InChI

InChI=1S/C29H20N2O5/c1-35-28(33)25-10-4-5-12-26(25)31-27(32)21(18-30)17-19-13-15-22(16-14-19)36-29(34)24-11-6-8-20-7-2-3-9-23(20)24/h2-17H,1H3,(H,31,32)/b21-17+