bis(phenylmethyl) 2-(4-ethoxyphenyl)-4-methyl-4-oxidanyl-6-oxidanylidene-cyclohexane-1,3-dicarboxylate

Systemtic Name: bis(phenylmethyl) 2-(4-ethoxyphenyl)-4-methyl-4-oxidanyl-6-oxidanylidene-cyclohexane-1,3-dicarboxylate Openeye Name: dibenzyl 2-(4-ethoxyphenyl)-4-hydroxy-4-methyl-6-oxo-cyclohexane-1,3-dicarboxylate CAS Name: 2-(4-ethoxyphenyl)-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-dicarboxylic acid bis(phenylmethyl) ester IUPAC Name: dibenzyl 2-(4-ethoxyphenyl)-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-dicarboxylate Traditional Name: 4-hydroxy-6-keto-4-methyl-2-p-phenetyl-cyclohexane-1,3-dicarboxylic acid dibenzyl ester Formula: C31H32O7 MolecularWeight: 516.58158

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2C(C(=O)CC(C2C(=O)OCC3=CC=CC=C3)(C)O)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=C(C=C1)C2C(C(=O)CC(C2C(=O)OCC3=CC=CC=C3)(C)O)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C31H32O7/c1-3-36-24-16-14-23(15-17-24)26-27(29(33)37-19-21-10-6-4-7-11-21)25(32)18-31(2,35)28(26)30(34)38-20-22-12-8-5-9-13-22/h4-17,26-28,35H,3,18-20H2,1-2H3