[2-[2-cyanoethyl(methyl)amino]-2-oxidanylidene-ethyl] 2-[(2-methoxyphenyl)amino]pyridine-3-carboxylate

Systemtic Name: [2-[2-cyanoethyl(methyl)amino]-2-oxidanylidene-ethyl] 2-[(2-methoxyphenyl)amino]pyridine-3-carboxylate Openeye Name: [2-[2-cyanoethyl(methyl)amino]-2-oxo-ethyl] 2-(2-methoxyanilino)pyridine-3-carboxylate CAS Name: 2-(2-methoxyanilino)-3-pyridinecarboxylic acid [2-[2-cyanoethyl(methyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[2-cyanoethyl(methyl)amino]-2-oxoethyl] 2-(2-methoxyanilino)pyridine-3-carboxylate Traditional Name: 2-(o-anisidino)nicotinic acid [2-[2-cyanoethyl(methyl)amino]-2-keto-ethyl] ester Formula: C19H20N4O4 MolecularWeight: 368.3865

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)C(=O)COC(=O)C1=C(N=CC=C1)NC2=CC=CC=C2OC

Isomeric SMILES

CN(CCC#N)C(=O)COC(=O)C1=C(N=CC=C1)NC2=CC=CC=C2OC

InChI

InChI=1S/C19H20N4O4/c1-23(12-6-10-20)17(24)13-27-19(25)14-7-5-11-21-18(14)22-15-8-3-4-9-16(15)26-2/h3-5,7-9,11H,6,12-13H2,1-2H3,(H,21,22)