4-methyl-2-(4-methylphenyl)-4-oxidanyl-6-oxidanylidene-1,2-bis(phenylmethyl)cyclohexane-1,3-dicarboxylic acid

Systemtic Name: 4-methyl-2-(4-methylphenyl)-4-oxidanyl-6-oxidanylidene-1,2-bis(phenylmethyl)cyclohexane-1,3-dicarboxylic acid Openeye Name: 1,2-dibenzyl-4-hydroxy-4-methyl-6-oxo-2-(p-tolyl)cyclohexane-1,3-dicarboxylic acid CAS Name: 4-hydroxy-4-methyl-2-(4-methylphenyl)-6-oxo-1,2-bis(phenylmethyl)cyclohexane-1,3-dicarboxylic acid IUPAC Name: 1,2-dibenzyl-4-hydroxy-4-methyl-2-(4-methylphenyl)-6-oxocyclohexane-1,3-dicarboxylic acid Traditional Name: 1,2-dibenzyl-4-hydroxy-6-keto-4-methyl-2-(p-tolyl)cyclohexane-1,3-dicarboxylic acid Formula: C30H30O6 MolecularWeight: 486.5556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2(C(C(CC(=O)C2(CC3=CC=CC=C3)C(=O)O)(C)O)C(=O)O)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2(C(C(CC(=O)C2(CC3=CC=CC=C3)C(=O)O)(C)O)C(=O)O)CC4=CC=CC=C4

InChI

InChI=1S/C30H30O6/c1-20-13-15-23(16-14-20)29(17-21-9-5-3-6-10-21)25(26(32)33)28(2,36)19-24(31)30(29,27(34)35)18-22-11-7-4-8-12-22/h3-16,25,36H,17-19H2,1-2H3,(H,32,33)(H,34,35)