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

Systemtic Name: [(1R,2R)-2-oxidanylcyclohexyl] (3S)-3-phenylheptanoate Openeye Name: [(1R,2R)-2-hydroxycyclohexyl] (3S)-3-phenylheptanoate CAS Name: (3S)-3-phenylheptanoic acid [(1R,2R)-2-hydroxycyclohexyl] ester IUPAC Name: [(1R,2R)-2-hydroxycyclohexyl] (3S)-3-phenylheptanoate Traditional Name: (3S)-3-phenylenanthic acid [(1R,2R)-2-hydroxycyclohexyl] ester Formula: C19H28O3 MolecularWeight: 304.42382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H28O3/c1-2-3-9-16(15-10-5-4-6-11-15)14-19(21)22-18-13-8-7-12-17(18)20/h4-6,10-11,16-18,20H,2-3,7-9,12-14H2,1H3/t16-,17+,18+/m0/s1