[(S)-[(1R,2R)-2-oxidanylcyclohexyl]-phenyl-methyl] benzoate

Systemtic Name: [(S)-[(1R,2R)-2-oxidanylcyclohexyl]-phenyl-methyl] benzoate Openeye Name: [(S)-[(1R,2R)-2-hydroxycyclohexyl]-phenyl-methyl] benzoate CAS Name: benzoic acid [(S)-[(1R,2R)-2-hydroxycyclohexyl]-phenylmethyl] ester IUPAC Name: [(S)-[(1R,2R)-2-hydroxycyclohexyl]-phenylmethyl] benzoate Traditional Name: benzoic acid [(S)-[(1R,2R)-2-hydroxycyclohexyl]-phenyl-methyl] ester Formula: C20H22O3 MolecularWeight: 310.38688

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C(C2=CC=CC=C2)OC(=O)C3=CC=CC=C3)O

Isomeric SMILES

C1CC[C@H]([C@@H](C1)[C@@H](C2=CC=CC=C2)OC(=O)C3=CC=CC=C3)O

InChI

InChI=1S/C20H22O3/c21-18-14-8-7-13-17(18)19(15-9-3-1-4-10-15)23-20(22)16-11-5-2-6-12-16/h1-6,9-12,17-19,21H,7-8,13-14H2/t17-,18-,19-/m1/s1