[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] 2,5-dimethylbenzoate

Systemtic Name: [(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] 2,5-dimethylbenzoate Openeye Name: [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] 2,5-dimethylbenzoate CAS Name: 2,5-dimethylbenzoic acid [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] ester IUPAC Name: [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] 2,5-dimethylbenzoate Traditional Name: 2,5-dimethylbenzoic acid [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] ester Formula: C19H28O2 MolecularWeight: 288.42442

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H28O2/c1-12(2)16-9-7-14(4)11-18(16)21-19(20)17-10-13(3)6-8-15(17)5/h6,8,10,12,14,16,18H,7,9,11H2,1-5H3/t14-,16+,18-/m1/s1