bis[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] (1S,2S)-cyclopentane-1,2-dicarboxylate

Systemtic Name: bis[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] (1S,2S)-cyclopentane-1,2-dicarboxylate Openeye Name: bis[(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] (1S,2S)-cyclopentane-1,2-dicarboxylate CAS Name: (1S,2S)-cyclopentane-1,2-dicarboxylic acid bis[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] ester IUPAC Name: bis[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] (1S,2S)-cyclopentane-1,2-dicarboxylate Traditional Name: (1S,2S)-cyclopentane-1,2-dicarboxylic acid bis[(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] ester Formula: C27H46O4 MolecularWeight: 434.65174

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)C2CCCC2C(=O)OC3CC(CCC3C(C)C)C)C(C)C

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)[C@H]2CCC[C@@H]2C(=O)O[C@@H]3C[C@@H](CC[C@H]3C(C)C)C)C(C)C

InChI

InChI=1S/C27H46O4/c1-16(2)20-12-10-18(5)14-24(20)30-26(28)22-8-7-9-23(22)27(29)31-25-15-19(6)11-13-21(25)17(3)4/h16-25H,7-15H2,1-6H3/t18-,19-,20+,21+,22+,23+,24-,25-/m1/s1