(phenylmethyl) 2-oxidanylideneoctanoate

Systemtic Name: (phenylmethyl) 2-oxidanylideneoctanoate Openeye Name: benzyl 2-oxooctanoate CAS Name: 2-oxooctanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-oxooctanoate Traditional Name: 2-ketocaprylic acid benzyl ester Formula: C15H20O3 MolecularWeight: 248.3175

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)C(=O)OCC1=CC=CC=C1

Isomeric SMILES

CCCCCCC(=O)C(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C15H20O3/c1-2-3-4-8-11-14(16)15(17)18-12-13-9-6-5-7-10-13/h5-7,9-10H,2-4,8,11-12H2,1H3