bis[(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] 2-prop-2-enylpropanedioate

Systemtic Name: bis[(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] 2-prop-2-enylpropanedioate Openeye Name: bis[(1R,2S,5R)-5-methyl-2-(1-methyl-1-phenyl-ethyl)cyclohexyl] 2-allylpropanedioate CAS Name: 2-prop-2-enylpropanedioic acid bis[(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] ester IUPAC Name: bis[(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] 2-prop-2-enylpropanedioate Traditional Name: 2-allylmalonic acid bis[(1R,2S,5R)-2-cumyl-5-methyl-cyclohexyl] ester Formula: C38H52O4 MolecularWeight: 572.81708

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)C(CC=C)C(=O)OC2CC(CCC2C(C)(C)C3=CC=CC=C3)C)C(C)(C)C4=CC=CC=C4

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)C(CC=C)C(=O)O[C@@H]2C[C@@H](CC[C@H]2C(C)(C)C3=CC=CC=C3)C)C(C)(C)C4=CC=CC=C4

InChI

InChI=1S/C38H52O4/c1-8-15-30(35(39)41-33-24-26(2)20-22-31(33)37(4,5)28-16-11-9-12-17-28)36(40)42-34-25-27(3)21-23-32(34)38(6,7)29-18-13-10-14-19-29/h8-14,16-19,26-27,30-34H,1,15,20-25H2,2-7H3/t26-,27-,31-,32-,33-,34-/m1/s1