ethyl 4-[(2-cyanophenyl)amino]-6-(3-methoxyphenyl)-2-oxidanylidene-cyclohex-3-ene-1-carboxylate

Systemtic Name: ethyl 4-[(2-cyanophenyl)amino]-6-(3-methoxyphenyl)-2-oxidanylidene-cyclohex-3-ene-1-carboxylate Openeye Name: ethyl 4-(2-cyanoanilino)-6-(3-methoxyphenyl)-2-oxo-cyclohex-3-ene-1-carboxylate CAS Name: 4-(2-cyanoanilino)-6-(3-methoxyphenyl)-2-oxo-1-cyclohex-3-enecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-cyanoanilino)-6-(3-methoxyphenyl)-2-oxocyclohex-3-ene-1-carboxylate Traditional Name: 4-(2-cyanoanilino)-2-keto-6-(3-methoxyphenyl)cyclohex-3-ene-1-carboxylic acid ethyl ester Formula: C23H22N2O4 MolecularWeight: 390.43178

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(CC(=CC1=O)NC2=CC=CC=C2C#N)C3=CC(=CC=C3)OC

Isomeric SMILES

CCOC(=O)C1C(CC(=CC1=O)NC2=CC=CC=C2C#N)C3=CC(=CC=C3)OC

InChI

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