ethyl 4-cyano-7-nitro-3-oxidanylidene-5H-pyrido[1,2-a]benzimidazole-2-carboxylate

Systemtic Name: ethyl 4-cyano-7-nitro-3-oxidanylidene-5H-pyrido[1,2-a]benzimidazole-2-carboxylate Openeye Name: ethyl 4-cyano-7-nitro-3-oxo-5H-pyrido[1,2-a]benzimidazole-2-carboxylate CAS Name: 4-cyano-7-nitro-3-oxo-5H-pyrido[1,2-a]benzimidazole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-cyano-7-nitro-3-oxo-5H-pyrido[1,2-a]benzimidazole-2-carboxylate Traditional Name: 4-cyano-3-keto-7-nitro-5H-pyrido[1,2-a]benzimidazole-2-carboxylic acid ethyl ester Formula: C15H10N4O5 MolecularWeight: 326.2637

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN2C3=C(C=C(C=C3)[N+](=O)[O-])NC2=C(C1=O)C#N

Isomeric SMILES

CCOC(=O)C1=CN2C3=C(C=C(C=C3)[N+](=O)[O-])NC2=C(C1=O)C#N

InChI

InChI=1S/C15H10N4O5/c1-2-24-15(21)10-7-18-12-4-3-8(19(22)23)5-11(12)17-14(18)9(6-16)13(10)20/h3-5,7,17H,2H2,1H3