[2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 2-ethoxypyridine-3-carboxylate

Systemtic Name: [2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 2-ethoxypyridine-3-carboxylate Openeye Name: [2-(2-cyanoethylamino)-2-oxo-ethyl] 2-ethoxypyridine-3-carboxylate CAS Name: 2-ethoxy-3-pyridinecarboxylic acid [2-(2-cyanoethylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-cyanoethylamino)-2-oxoethyl] 2-ethoxypyridine-3-carboxylate Traditional Name: 2-ethoxynicotinic acid [2-(2-cyanoethylamino)-2-keto-ethyl] ester Formula: C13H15N3O4 MolecularWeight: 277.2759

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC=N1)C(=O)OCC(=O)NCCC#N

Isomeric SMILES

CCOC1=C(C=CC=N1)C(=O)OCC(=O)NCCC#N

InChI

InChI=1S/C13H15N3O4/c1-2-19-12-10(5-3-7-16-12)13(18)20-9-11(17)15-8-4-6-14/h3,5,7H,2,4,8-9H2,1H3,(H,15,17)