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

Systemtic Name: ethyl (1S,6S)-4-(3,4-dimethoxyphenyl)-6-(4-methylphenyl)-2-oxidanylidene-cyclohex-3-ene-1-carboxylate Openeye Name: ethyl (1S,6S)-4-(3,4-dimethoxyphenyl)-2-oxo-6-(p-tolyl)cyclohex-3-ene-1-carboxylate CAS Name: (1S,6S)-4-(3,4-dimethoxyphenyl)-6-(4-methylphenyl)-2-oxo-1-cyclohex-3-enecarboxylic acid ethyl ester IUPAC Name: ethyl (1S,6S)-4-(3,4-dimethoxyphenyl)-6-(4-methylphenyl)-2-oxocyclohex-3-ene-1-carboxylate Traditional Name: (1S,6S)-4-(3,4-dimethoxyphenyl)-2-keto-6-(p-tolyl)cyclohex-3-ene-1-carboxylic acid ethyl ester Formula: C24H26O5 MolecularWeight: 394.46024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H26O5/c1-5-29-24(26)23-19(16-8-6-15(2)7-9-16)12-18(13-20(23)25)17-10-11-21(27-3)22(14-17)28-4/h6-11,13-14,19,23H,5,12H2,1-4H3/t19-,23+/m1/s1