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

Systemtic Name: [(1S,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] 2-methylbenzoate Openeye Name: [(1S,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] 2-methylbenzoate CAS Name: 2-methylbenzoic acid [(1S,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] ester IUPAC Name: [(1S,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] 2-methylbenzoate Traditional Name: 2-methylbenzoic acid [(1S,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] ester Formula: C18H26O2 MolecularWeight: 274.39784

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)C2=CC=CC=C2C)C(C)C

Isomeric SMILES

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

InChI

InChI=1S/C18H26O2/c1-12(2)15-10-9-13(3)11-17(15)20-18(19)16-8-6-5-7-14(16)4/h5-8,12-13,15,17H,9-11H2,1-4H3/t13-,15+,17+/m1/s1