[(1R,2R)-2-oxidanylcyclohexyl] (3S)-3-phenylbutanoate

Systemtic Name: [(1R,2R)-2-oxidanylcyclohexyl] (3S)-3-phenylbutanoate Openeye Name: [(1R,2R)-2-hydroxycyclohexyl] (3S)-3-phenylbutanoate CAS Name: (3S)-3-phenylbutanoic acid [(1R,2R)-2-hydroxycyclohexyl] ester IUPAC Name: [(1R,2R)-2-hydroxycyclohexyl] (3S)-3-phenylbutanoate Traditional Name: (3S)-3-phenylbutyric acid [(1R,2R)-2-hydroxycyclohexyl] ester Formula: C16H22O3 MolecularWeight: 262.34408

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)OC1CCCCC1O)C2=CC=CC=C2

Isomeric SMILES

C[C@@H](CC(=O)O[C@@H]1CCCC[C@H]1O)C2=CC=CC=C2

InChI

InChI=1S/C16H22O3/c1-12(13-7-3-2-4-8-13)11-16(18)19-15-10-6-5-9-14(15)17/h2-4,7-8,12,14-15,17H,5-6,9-11H2,1H3/t12-,14+,15+/m0/s1