[4-[(E)-2-cyano-3-[(2,3-dimethylphenyl)amino]-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenyl] cyclopropanecarboxylate

Systemtic Name: [4-[(E)-2-cyano-3-[(2,3-dimethylphenyl)amino]-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenyl] cyclopropanecarboxylate Openeye Name: [4-[(E)-2-cyano-3-(2,3-dimethylanilino)-3-oxo-prop-1-enyl]-2-methoxy-phenyl] cyclopropanecarboxylate CAS Name: cyclopropanecarboxylic acid [4-[(E)-2-cyano-3-(2,3-dimethylanilino)-3-oxoprop-1-enyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(E)-2-cyano-3-(2,3-dimethylanilino)-3-oxoprop-1-enyl]-2-methoxyphenyl] cyclopropanecarboxylate Traditional Name: cyclopropanecarboxylic acid [4-[(E)-2-cyano-3-(2,3-dimethylanilino)-3-keto-prop-1-enyl]-2-methoxy-phenyl] ester Formula: C23H22N2O4 MolecularWeight: 390.43178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)C(=CC2=CC(=C(C=C2)OC(=O)C3CC3)OC)C#N)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)/C(=C/C2=CC(=C(C=C2)OC(=O)C3CC3)OC)/C#N)C

InChI

InChI=1S/C23H22N2O4/c1-14-5-4-6-19(15(14)2)25-22(26)18(13-24)11-16-7-10-20(21(12-16)28-3)29-23(27)17-8-9-17/h4-7,10-12,17H,8-9H2,1-3H3,(H,25,26)/b18-11+