[(2S)-octan-2-yl] (2R)-2-oxidanyl-2-phenyl-ethanoate

Systemtic Name: [(2S)-octan-2-yl] (2R)-2-oxidanyl-2-phenyl-ethanoate Openeye Name: [(1S)-1-methylheptyl] (2R)-2-hydroxy-2-phenyl-acetate CAS Name: (2R)-2-hydroxy-2-phenylacetic acid [(2S)-octan-2-yl] ester IUPAC Name: [(2S)-octan-2-yl] (2R)-2-hydroxy-2-phenylacetate Traditional Name: (2R)-2-hydroxy-2-phenyl-acetic acid [(1S)-1-methylheptyl] ester Formula: C16H24O3 MolecularWeight: 264.35996

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OC(=O)C(C1=CC=CC=C1)O

Isomeric SMILES

CCCCCC[C@H](C)OC(=O)[C@@H](C1=CC=CC=C1)O

InChI

InChI=1S/C16H24O3/c1-3-4-5-7-10-13(2)19-16(18)15(17)14-11-8-6-9-12-14/h6,8-9,11-13,15,17H,3-5,7,10H2,1-2H3/t13-,15+/m0/s1