bis[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] 2-[2-(4-methylphenyl)-2-oxidanylidene-ethylidene]propanedioate

Systemtic Name: bis[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] 2-[2-(4-methylphenyl)-2-oxidanylidene-ethylidene]propanedioate Openeye Name: bis[(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] 2-[2-oxo-2-(p-tolyl)ethylidene]propanedioate CAS Name: 2-[2-(4-methylphenyl)-2-oxoethylidene]propanedioic acid bis[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] ester IUPAC Name: bis[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] 2-[2-(4-methylphenyl)-2-oxoethylidene]propanedioate Traditional Name: 2-[2-keto-2-(p-tolyl)ethylidene]malonic acid bis[(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] ester Formula: C32H46O5 MolecularWeight: 510.70464

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)C(=CC(=O)C2=CC=C(C=C2)C)C(=O)OC3CC(CCC3C(C)C)C)C(C)C

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)C(=CC(=O)C2=CC=C(C=C2)C)C(=O)O[C@@H]3C[C@@H](CC[C@H]3C(C)C)C)C(C)C

InChI

InChI=1S/C32H46O5/c1-19(2)25-14-10-22(6)16-29(25)36-31(34)27(18-28(33)24-12-8-21(5)9-13-24)32(35)37-30-17-23(7)11-15-26(30)20(3)4/h8-9,12-13,18-20,22-23,25-26,29-30H,10-11,14-17H2,1-7H3/t22-,23-,25+,26+,29-,30-/m1/s1