ethyl (1S,6S)-6-(4-dimethylaminophenyl)-4-(4-methylphenyl)-2-oxidanylidene-cyclohex-3-ene-1-carboxylate

Systemtic Name: ethyl (1S,6S)-6-(4-dimethylaminophenyl)-4-(4-methylphenyl)-2-oxidanylidene-cyclohex-3-ene-1-carboxylate Openeye Name: ethyl (1S,6S)-6-(4-dimethylaminophenyl)-2-oxo-4-(p-tolyl)cyclohex-3-ene-1-carboxylate CAS Name: (1S,6S)-6-(4-dimethylaminophenyl)-4-(4-methylphenyl)-2-oxo-1-cyclohex-3-enecarboxylic acid ethyl ester IUPAC Name: ethyl (1S,6S)-6-(4-dimethylaminophenyl)-4-(4-methylphenyl)-2-oxocyclohex-3-ene-1-carboxylate Traditional Name: (1S,6S)-6-(4-dimethylaminophenyl)-2-keto-4-(p-tolyl)cyclohex-3-ene-1-carboxylic acid ethyl ester Formula: C24H27NO3 MolecularWeight: 377.47608

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(CC(=CC1=O)C2=CC=C(C=C2)C)C3=CC=C(C=C3)N(C)C

Isomeric SMILES

CCOC(=O)[C@H]1[C@H](CC(=CC1=O)C2=CC=C(C=C2)C)C3=CC=C(C=C3)N(C)C

InChI

InChI=1S/C24H27NO3/c1-5-28-24(27)23-21(18-10-12-20(13-11-18)25(3)4)14-19(15-22(23)26)17-8-6-16(2)7-9-17/h6-13,15,21,23H,5,14H2,1-4H3/t21-,23+/m1/s1