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

Systemtic Name: [(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] pentanoate Openeye Name: [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] pentanoate CAS Name: pentanoic acid [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] ester IUPAC Name: [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] pentanoate Traditional Name: valeric acid [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] ester Formula: C15H25O2 MolecularWeight: 237.3578

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Descriptors Computed from Structure

Canonical SMILES:

C[CH][CH][CH]C(=O)OC1CC(CCC1C(C)C)C

Isomeric SMILES

C[CH][CH][CH]C(=O)O[C@@H]1C[C@@H](CC[C@H]1C(C)C)C

InChI

InChI=1S/C15H25O2/c1-5-6-7-15(16)17-14-10-12(4)8-9-13(14)11(2)3/h5-7,11-14H,8-10H2,1-4H3/t12-,13+,14-/m1/s1