(phenylmethyl) 2-ethanoylnonanoate

Systemtic Name: (phenylmethyl) 2-ethanoylnonanoate Openeye Name: benzyl 2-acetylnonanoate CAS Name: 2-acetylnonanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-acetylnonanoate Traditional Name: 2-acetylpelargonic acid benzyl ester Formula: C18H26O3 MolecularWeight: 290.39724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H26O3/c1-3-4-5-6-10-13-17(15(2)19)18(20)21-14-16-11-8-7-9-12-16/h7-9,11-12,17H,3-6,10,13-14H2,1-2H3