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

Systemtic Name: [2-[2-cyanoethyl(methyl)amino]-2-oxidanylidene-ethyl] pyridine-2-carboxylate Openeye Name: [2-[2-cyanoethyl(methyl)amino]-2-oxo-ethyl] pyridine-2-carboxylate CAS Name: 2-pyridinecarboxylic acid [2-[2-cyanoethyl(methyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[2-cyanoethyl(methyl)amino]-2-oxoethyl] pyridine-2-carboxylate Traditional Name: picolinic acid [2-[2-cyanoethyl(methyl)amino]-2-keto-ethyl] ester Formula: C12H13N3O3 MolecularWeight: 247.24992

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)C(=O)COC(=O)C1=CC=CC=N1

Isomeric SMILES

CN(CCC#N)C(=O)COC(=O)C1=CC=CC=N1

InChI

InChI=1S/C12H13N3O3/c1-15(8-4-6-13)11(16)9-18-12(17)10-5-2-3-7-14-10/h2-3,5,7H,4,8-9H2,1H3