[2-oxidanylidene-2-(pyridin-3-ylmethylamino)ethyl] 2-chloranylpyridine-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-(pyridin-3-ylmethylamino)ethyl] 2-chloranylpyridine-4-carboxylate Openeye Name: [2-oxo-2-(3-pyridylmethylamino)ethyl] 2-chloropyridine-4-carboxylate CAS Name: 2-chloro-4-pyridinecarboxylic acid [2-oxo-2-(3-pyridinylmethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pyridin-3-ylmethylamino)ethyl] 2-chloropyridine-4-carboxylate Traditional Name: 2-chloroisonicotinic acid [2-keto-2-(3-pyridylmethylamino)ethyl] ester Formula: C14H12ClN3O3 MolecularWeight: 305.71638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CNC(=O)COC(=O)C2=CC(=NC=C2)Cl

Isomeric SMILES

C1=CC(=CN=C1)CNC(=O)COC(=O)C2=CC(=NC=C2)Cl

InChI

InChI=1S/C14H12ClN3O3/c15-12-6-11(3-5-17-12)14(20)21-9-13(19)18-8-10-2-1-4-16-7-10/h1-7H,8-9H2,(H,18,19)