(2-oxidanylidene-1H-pyridin-3-yl) heptanoate

Systemtic Name: (2-oxidanylidene-1H-pyridin-3-yl) heptanoate Openeye Name: (2-oxo-1H-pyridin-3-yl) heptanoate CAS Name: heptanoic acid (2-oxo-1H-pyridin-3-yl) ester IUPAC Name: (2-oxo-1H-pyridin-3-yl) heptanoate Traditional Name: enanthic acid (2-keto-1H-pyridin-3-yl) ester Formula: C12H17NO3 MolecularWeight: 223.26828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)OC1=CC=CNC1=O

Isomeric SMILES

CCCCCCC(=O)OC1=CC=CNC1=O

InChI

InChI=1S/C12H17NO3/c1-2-3-4-5-8-11(14)16-10-7-6-9-13-12(10)15/h6-7,9H,2-5,8H2,1H3,(H,13,15)