[(2S)-2-methyl-5-oxidanyl-pentyl] benzoate

Systemtic Name: [(2S)-2-methyl-5-oxidanyl-pentyl] benzoate Openeye Name: [(2S)-5-hydroxy-2-methyl-pentyl] benzoate CAS Name: benzoic acid [(2S)-5-hydroxy-2-methylpentyl] ester IUPAC Name: [(2S)-5-hydroxy-2-methylpentyl] benzoate Traditional Name: benzoic acid [(2S)-5-hydroxy-2-methyl-pentyl] ester Formula: C13H18O3 MolecularWeight: 222.28022

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCO)COC(=O)C1=CC=CC=C1

Isomeric SMILES

C[C@@H](CCCO)COC(=O)C1=CC=CC=C1

InChI

InChI=1S/C13H18O3/c1-11(6-5-9-14)10-16-13(15)12-7-3-2-4-8-12/h2-4,7-8,11,14H,5-6,9-10H2,1H3/t11-/m0/s1