[(2R,3S,4S)-3-methyl-4-oxidanyl-pentan-2-yl] benzoate

Systemtic Name: [(2R,3S,4S)-3-methyl-4-oxidanyl-pentan-2-yl] benzoate Openeye Name: [(1R,2S,3S)-3-hydroxy-1,2-dimethyl-butyl] benzoate CAS Name: benzoic acid [(2R,3S,4S)-4-hydroxy-3-methylpentan-2-yl] ester IUPAC Name: [(2R,3S,4S)-4-hydroxy-3-methylpentan-2-yl] benzoate Traditional Name: benzoic acid [(1R,2S,3S)-3-hydroxy-1,2-dimethyl-butyl] ester Formula: C13H18O3 MolecularWeight: 222.28022

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18O3/c1-9(10(2)14)11(3)16-13(15)12-7-5-4-6-8-12/h4-11,14H,1-3H3/t9-,10-,11+/m0/s1