[(1S,2S)-2-oxidanylcyclohexyl] 3-methylbenzoate

Systemtic Name: [(1S,2S)-2-oxidanylcyclohexyl] 3-methylbenzoate Openeye Name: [(1S,2S)-2-hydroxycyclohexyl] 3-methylbenzoate CAS Name: 3-methylbenzoic acid [(1S,2S)-2-hydroxycyclohexyl] ester IUPAC Name: [(1S,2S)-2-hydroxycyclohexyl] 3-methylbenzoate Traditional Name: 3-methylbenzoic acid [(1S,2S)-2-hydroxycyclohexyl] ester Formula: C14H18O3 MolecularWeight: 234.29092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)OC2CCCCC2O

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)O[C@H]2CCCC[C@@H]2O

InChI

InChI=1S/C14H18O3/c1-10-5-4-6-11(9-10)14(16)17-13-8-3-2-7-12(13)15/h4-6,9,12-13,15H,2-3,7-8H2,1H3/t12-,13-/m0/s1