[(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] 4-azanyl-3,5,6-tris(chloranyl)pyridine-2-carboxylate

Systemtic Name: [(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] 4-azanyl-3,5,6-tris(chloranyl)pyridine-2-carboxylate Openeye Name: [(E)-4-amino-3-cyano-2-oxo-pent-3-enyl] 4-amino-3,5,6-trichloro-pyridine-2-carboxylate CAS Name: 4-amino-3,5,6-trichloro-2-pyridinecarboxylic acid [(E)-4-amino-3-cyano-2-oxopent-3-enyl] ester IUPAC Name: [(E)-4-amino-3-cyano-2-oxopent-3-enyl] 4-amino-3,5,6-trichloropyridine-2-carboxylate Traditional Name: 4-amino-3,5,6-trichloro-picolinic acid [(E)-4-amino-3-cyano-2-keto-pent-3-enyl] ester Formula: C12H9Cl3N4O3 MolecularWeight: 363.58386

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C#N)C(=O)COC(=O)C1=NC(=C(C(=C1Cl)N)Cl)Cl)N

Isomeric SMILES

C/C(=C(/C#N)\C(=O)COC(=O)C1=NC(=C(C(=C1Cl)N)Cl)Cl)/N

InChI

InChI=1S/C12H9Cl3N4O3/c1-4(17)5(2-16)6(20)3-22-12(21)10-7(13)9(18)8(14)11(15)19-10/h3,17H2,1H3,(H2,18,19)/b5-4+