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

Systemtic Name: ethyl (1S,6R)-4,6-bis(4-methylphenyl)-2-oxidanylidene-cyclohex-3-ene-1-carboxylate Openeye Name: ethyl (1S,6R)-2-oxo-4,6-bis(p-tolyl)cyclohex-3-ene-1-carboxylate CAS Name: (1S,6R)-4,6-bis(4-methylphenyl)-2-oxo-1-cyclohex-3-enecarboxylic acid ethyl ester IUPAC Name: ethyl (1S,6R)-4,6-bis(4-methylphenyl)-2-oxocyclohex-3-ene-1-carboxylate Traditional Name: (1S,6R)-2-keto-4,6-bis(p-tolyl)cyclohex-3-ene-1-carboxylic acid ethyl ester Formula: C23H24O3 MolecularWeight: 348.43486

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H24O3/c1-4-26-23(25)22-20(18-11-7-16(3)8-12-18)13-19(14-21(22)24)17-9-5-15(2)6-10-17/h5-12,14,20,22H,4,13H2,1-3H3/t20-,22-/m0/s1