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

Systemtic Name: [(1S,2R)-2-[(S)-oxidanyl(phenyl)methyl]-2-phenyl-cyclohexyl] benzoate Openeye Name: [(1S,2R)-2-[(S)-hydroxy(phenyl)methyl]-2-phenyl-cyclohexyl] benzoate CAS Name: benzoic acid [(1S,2R)-2-[(S)-hydroxy(phenyl)methyl]-2-phenylcyclohexyl] ester IUPAC Name: [(1S,2R)-2-[(S)-hydroxy(phenyl)methyl]-2-phenylcyclohexyl] benzoate Traditional Name: benzoic acid [(1S,2R)-2-[(S)-hydroxy(phenyl)methyl]-2-phenyl-cyclohexyl] ester Formula: C26H26O3 MolecularWeight: 386.48284

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)OC(=O)C2=CC=CC=C2)(C3=CC=CC=C3)C(C4=CC=CC=C4)O

Isomeric SMILES

C1CC[C@@]([C@H](C1)OC(=O)C2=CC=CC=C2)(C3=CC=CC=C3)[C@H](C4=CC=CC=C4)O

InChI

InChI=1S/C26H26O3/c27-24(20-12-4-1-5-13-20)26(22-16-8-3-9-17-22)19-11-10-18-23(26)29-25(28)21-14-6-2-7-15-21/h1-9,12-17,23-24,27H,10-11,18-19H2/t23-,24-,26-/m0/s1