(phenylmethyl) 2-oxidanylideneheptanoate

Systemtic Name: (phenylmethyl) 2-oxidanylideneheptanoate Openeye Name: benzyl 2-oxoheptanoate CAS Name: 2-oxoheptanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-oxoheptanoate Traditional Name: 2-ketoenanthic acid benzyl ester Formula: C14H18O3 MolecularWeight: 234.29092

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18O3/c1-2-3-5-10-13(15)14(16)17-11-12-8-6-4-7-9-12/h4,6-9H,2-3,5,10-11H2,1H3