[(1S,2R,3R)-3-methyl-2-propan-2-yl-cyclohexyl] ethanoate

Systemtic Name: [(1S,2R,3R)-3-methyl-2-propan-2-yl-cyclohexyl] ethanoate Openeye Name: [(1S,2R,3R)-2-isopropyl-3-methyl-cyclohexyl] acetate CAS Name: acetic acid [(1S,2R,3R)-3-methyl-2-propan-2-ylcyclohexyl] ester IUPAC Name: [(1S,2R,3R)-3-methyl-2-propan-2-ylcyclohexyl] acetate Traditional Name: acetic acid [(1S,2R,3R)-2-isopropyl-3-methyl-cyclohexyl] ester Formula: C12H22O2 MolecularWeight: 198.30188

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C(C)C)OC(=O)C

Isomeric SMILES

C[C@@H]1CCC[C@@H]([C@@H]1C(C)C)OC(=O)C

InChI

InChI=1S/C12H22O2/c1-8(2)12-9(3)6-5-7-11(12)14-10(4)13/h8-9,11-12H,5-7H2,1-4H3/t9-,11+,12-/m1/s1