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

Systemtic Name: ethyl (1S,6S)-4-(3-methoxyphenyl)-2-oxidanylidene-6-(4-propan-2-ylphenyl)cyclohex-3-ene-1-carboxylate Openeye Name: ethyl (1S,6S)-6-(4-isopropylphenyl)-4-(3-methoxyphenyl)-2-oxo-cyclohex-3-ene-1-carboxylate CAS Name: (1S,6S)-4-(3-methoxyphenyl)-2-oxo-6-(4-propan-2-ylphenyl)-1-cyclohex-3-enecarboxylic acid ethyl ester IUPAC Name: ethyl (1S,6S)-4-(3-methoxyphenyl)-2-oxo-6-(4-propan-2-ylphenyl)cyclohex-3-ene-1-carboxylate Traditional Name: (1S,6S)-2-keto-4-(3-methoxyphenyl)-6-p-cumenyl-cyclohex-3-ene-1-carboxylic acid ethyl ester Formula: C25H28O4 MolecularWeight: 392.48742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H28O4/c1-5-29-25(27)24-22(18-11-9-17(10-12-18)16(2)3)14-20(15-23(24)26)19-7-6-8-21(13-19)28-4/h6-13,15-16,22,24H,5,14H2,1-4H3/t22-,24+/m1/s1