[(S)-[(1R,2R)-2-oxidanylcyclohex-3-en-1-yl]-phenyl-methyl] benzoate

Systemtic Name: [(S)-[(1R,2R)-2-oxidanylcyclohex-3-en-1-yl]-phenyl-methyl] benzoate Openeye Name: [(S)-[(1R,2R)-2-hydroxycyclohex-3-en-1-yl]-phenyl-methyl] benzoate CAS Name: benzoic acid [(S)-[(1R,2R)-2-hydroxy-1-cyclohex-3-enyl]-phenylmethyl] ester IUPAC Name: [(S)-[(1R,2R)-2-hydroxycyclohex-3-en-1-yl]-phenylmethyl] benzoate Traditional Name: benzoic acid [(S)-[(1R,2R)-2-hydroxycyclohex-3-en-1-yl]-phenyl-methyl] ester Formula: C20H20O3 MolecularWeight: 308.371

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(C=C1)O)C(C2=CC=CC=C2)OC(=O)C3=CC=CC=C3

Isomeric SMILES

C1C[C@H]([C@@H](C=C1)O)[C@@H](C2=CC=CC=C2)OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H20O3/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/h1-6,8-12,14,17-19,21H,7,13H2/t17-,18-,19-/m1/s1