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

Systemtic Name: ethyl (1S,6S)-6-(4-dimethylaminophenyl)-4-(4-methoxyphenyl)-2-oxidanylidene-cyclohex-3-ene-1-carboxylate Openeye Name: ethyl (1S,6S)-6-(4-dimethylaminophenyl)-4-(4-methoxyphenyl)-2-oxo-cyclohex-3-ene-1-carboxylate CAS Name: (1S,6S)-6-(4-dimethylaminophenyl)-4-(4-methoxyphenyl)-2-oxo-1-cyclohex-3-enecarboxylic acid ethyl ester IUPAC Name: ethyl (1S,6S)-6-(4-dimethylaminophenyl)-4-(4-methoxyphenyl)-2-oxocyclohex-3-ene-1-carboxylate Traditional Name: (1S,6S)-6-(4-dimethylaminophenyl)-2-keto-4-(4-methoxyphenyl)cyclohex-3-ene-1-carboxylic acid ethyl ester Formula: C24H27NO4 MolecularWeight: 393.47548

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C24H27NO4/c1-5-29-24(27)23-21(17-6-10-19(11-7-17)25(2)3)14-18(15-22(23)26)16-8-12-20(28-4)13-9-16/h6-13,15,21,23H,5,14H2,1-4H3/t21-,23+/m1/s1