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

Systemtic Name: ethyl (1S,6S)-6-(2-ethoxyphenyl)-4-(4-methylphenyl)-2-oxidanylidene-cyclohex-3-ene-1-carboxylate Openeye Name: ethyl (1S,6S)-6-(2-ethoxyphenyl)-2-oxo-4-(p-tolyl)cyclohex-3-ene-1-carboxylate CAS Name: (1S,6S)-6-(2-ethoxyphenyl)-4-(4-methylphenyl)-2-oxo-1-cyclohex-3-enecarboxylic acid ethyl ester IUPAC Name: ethyl (1S,6S)-6-(2-ethoxyphenyl)-4-(4-methylphenyl)-2-oxocyclohex-3-ene-1-carboxylate Traditional Name: (1S,6S)-2-keto-6-o-phenetyl-4-(p-tolyl)cyclohex-3-ene-1-carboxylic acid ethyl ester Formula: C24H26O4 MolecularWeight: 378.46084

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C2CC(=CC(=O)C2C(=O)OCC)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC1=CC=CC=C1[C@H]2CC(=CC(=O)[C@H]2C(=O)OCC)C3=CC=C(C=C3)C

InChI

InChI=1S/C24H26O4/c1-4-27-22-9-7-6-8-19(22)20-14-18(17-12-10-16(3)11-13-17)15-21(25)23(20)24(26)28-5-2/h6-13,15,20,23H,4-5,14H2,1-3H3/t20-,23+/m1/s1