bis[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] naphthalene-2,3-dicarboxylate

Systemtic Name: bis[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] naphthalene-2,3-dicarboxylate Openeye Name: bis[(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] naphthalene-2,3-dicarboxylate CAS Name: naphthalene-2,3-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] naphthalene-2,3-dicarboxylate Traditional Name: naphthalene-2,3-dicarboxylic acid bis[(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] ester Formula: C32H44O4 MolecularWeight: 492.68936

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)C2=CC3=CC=CC=C3C=C2C(=O)OC4CC(CCC4C(C)C)C)C(C)C

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)C2=CC3=CC=CC=C3C=C2C(=O)O[C@@H]4C[C@@H](CC[C@H]4C(C)C)C)C(C)C

InChI

InChI=1S/C32H44O4/c1-19(2)25-13-11-21(5)15-29(25)35-31(33)27-17-23-9-7-8-10-24(23)18-28(27)32(34)36-30-16-22(6)12-14-26(30)20(3)4/h7-10,17-22,25-26,29-30H,11-16H2,1-6H3/t21-,22-,25+,26+,29-,30-/m1/s1