[(3R)-3-methyl-3,5-bis(oxidanyl)pentyl] benzoate

Systemtic Name: [(3R)-3-methyl-3,5-bis(oxidanyl)pentyl] benzoate Openeye Name: [(3R)-3,5-dihydroxy-3-methyl-pentyl] benzoate CAS Name: benzoic acid [(3R)-3,5-dihydroxy-3-methylpentyl] ester IUPAC Name: [(3R)-3,5-dihydroxy-3-methylpentyl] benzoate Traditional Name: benzoic acid [(3R)-3,5-dihydroxy-3-methyl-pentyl] ester Formula: C13H18O4 MolecularWeight: 238.27962

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCO)(CCOC(=O)C1=CC=CC=C1)O

Isomeric SMILES

C[C@@](CCO)(CCOC(=O)C1=CC=CC=C1)O

InChI

InChI=1S/C13H18O4/c1-13(16,7-9-14)8-10-17-12(15)11-5-3-2-4-6-11/h2-6,14,16H,7-10H2,1H3/t13-/m1/s1