(4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 5-bromanylpyridine-3-carboxylate

Systemtic Name: (4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 5-bromanylpyridine-3-carboxylate Openeye Name: (3-cyano-4-imino-2-oxo-pentyl) 5-bromopyridine-3-carboxylate CAS Name: 5-bromo-3-pyridinecarboxylic acid (3-cyano-4-imino-2-oxopentyl) ester IUPAC Name: (3-cyano-4-imino-2-oxopentyl) 5-bromopyridine-3-carboxylate Traditional Name: 5-bromonicotinic acid (3-cyano-4-imino-2-keto-pentyl) ester Formula: C12H10BrN3O3 MolecularWeight: 324.1301

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)COC(=O)C1=CC(=CN=C1)Br

Isomeric SMILES

CC(=N)C(C#N)C(=O)COC(=O)C1=CC(=CN=C1)Br

InChI

InChI=1S/C12H10BrN3O3/c1-7(15)10(3-14)11(17)6-19-12(18)8-2-9(13)5-16-4-8/h2,4-5,10,15H,6H2,1H3