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

Systemtic Name: ethyl (1S,6S)-6-(3-methoxyphenyl)-4-(4-methylphenyl)-2-oxidanylidene-cyclohex-3-ene-1-carboxylate Openeye Name: ethyl (1S,6S)-6-(3-methoxyphenyl)-2-oxo-4-(p-tolyl)cyclohex-3-ene-1-carboxylate CAS Name: (1S,6S)-6-(3-methoxyphenyl)-4-(4-methylphenyl)-2-oxo-1-cyclohex-3-enecarboxylic acid ethyl ester IUPAC Name: ethyl (1S,6S)-6-(3-methoxyphenyl)-4-(4-methylphenyl)-2-oxocyclohex-3-ene-1-carboxylate Traditional Name: (1S,6S)-2-keto-6-(3-methoxyphenyl)-4-(p-tolyl)cyclohex-3-ene-1-carboxylic acid ethyl ester Formula: C23H24O4 MolecularWeight: 364.43426

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H24O4/c1-4-27-23(25)22-20(17-6-5-7-19(12-17)26-3)13-18(14-21(22)24)16-10-8-15(2)9-11-16/h5-12,14,20,22H,4,13H2,1-3H3/t20-,22+/m1/s1