[(2S)-1-oxidanylidenenonan-2-yl] benzoate

Systemtic Name: [(2S)-1-oxidanylidenenonan-2-yl] benzoate Openeye Name: [(1S)-1-formyloctyl] benzoate CAS Name: benzoic acid [(2S)-1-oxononan-2-yl] ester IUPAC Name: [(2S)-1-oxononan-2-yl] benzoate Traditional Name: benzoic acid [(1S)-1-formyloctyl] ester Formula: C16H22O3 MolecularWeight: 262.34408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCCCC[C@@H](C=O)OC(=O)C1=CC=CC=C1

InChI

InChI=1S/C16H22O3/c1-2-3-4-5-9-12-15(13-17)19-16(18)14-10-7-6-8-11-14/h6-8,10-11,13,15H,2-5,9,12H2,1H3/t15-/m0/s1