[(3S)-2-oxidanylidene-3-(phenylcarbonyloxy)heptyl] benzoate

Systemtic Name: [(3S)-2-oxidanylidene-3-(phenylcarbonyloxy)heptyl] benzoate Openeye Name: [(3S)-3-benzoyloxy-2-oxo-heptyl] benzoate CAS Name: benzoic acid [(3S)-3-benzoyloxy-2-oxoheptyl] ester IUPAC Name: [(3S)-3-benzoyloxy-2-oxoheptyl] benzoate Traditional Name: benzoic acid [(3S)-3-benzoyloxy-2-keto-heptyl] ester Formula: C21H22O5 MolecularWeight: 354.39638

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)COC(=O)C1=CC=CC=C1)OC(=O)C2=CC=CC=C2

Isomeric SMILES

CCCC[C@@H](C(=O)COC(=O)C1=CC=CC=C1)OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C21H22O5/c1-2-3-14-19(26-21(24)17-12-8-5-9-13-17)18(22)15-25-20(23)16-10-6-4-7-11-16/h4-13,19H,2-3,14-15H2,1H3/t19-/m0/s1