[2-[4-(butanoylamino)phenyl]-2-oxidanylidene-ethyl] pyridine-3-carboxylate

Systemtic Name: [2-[4-(butanoylamino)phenyl]-2-oxidanylidene-ethyl] pyridine-3-carboxylate Openeye Name: [2-[4-(butanoylamino)phenyl]-2-oxo-ethyl] pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [2-oxo-2-[4-(1-oxobutylamino)phenyl]ethyl] ester IUPAC Name: [2-[4-(butanoylamino)phenyl]-2-oxoethyl] pyridine-3-carboxylate Traditional Name: nicotinic acid [2-(4-butyramidophenyl)-2-keto-ethyl] ester Formula: C18H18N2O4 MolecularWeight: 326.34652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC=C(C=C1)C(=O)COC(=O)C2=CN=CC=C2

Isomeric SMILES

CCCC(=O)NC1=CC=C(C=C1)C(=O)COC(=O)C2=CN=CC=C2

InChI

InChI=1S/C18H18N2O4/c1-2-4-17(22)20-15-8-6-13(7-9-15)16(21)12-24-18(23)14-5-3-10-19-11-14/h3,5-11H,2,4,12H2,1H3,(H,20,22)