methyl 2-[(3-cyano-5-nitro-2-oxidanylidene-pyridin-1-yl)methyl]-4-methyl-quinoline-3-carboxylate

Systemtic Name: methyl 2-[(3-cyano-5-nitro-2-oxidanylidene-pyridin-1-yl)methyl]-4-methyl-quinoline-3-carboxylate Openeye Name: methyl 2-[(3-cyano-5-nitro-2-oxo-1-pyridyl)methyl]-4-methyl-quinoline-3-carboxylate CAS Name: 2-[(3-cyano-5-nitro-2-oxo-1-pyridinyl)methyl]-4-methyl-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[(3-cyano-5-nitro-2-oxopyridin-1-yl)methyl]-4-methylquinoline-3-carboxylate Traditional Name: 2-[(3-cyano-2-keto-5-nitro-1-pyridyl)methyl]-4-methyl-quinoline-3-carboxylic acid methyl ester Formula: C19H14N4O5 MolecularWeight: 378.33826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)CN3C=C(C=C(C3=O)C#N)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)CN3C=C(C=C(C3=O)C#N)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C19H14N4O5/c1-11-14-5-3-4-6-15(14)21-16(17(11)19(25)28-2)10-22-9-13(23(26)27)7-12(8-20)18(22)24/h3-7,9H,10H2,1-2H3