6-nitro-3-[(4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl]quinazolin-4-one

Systemtic Name: 6-nitro-3-[(4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl]quinazolin-4-one Openeye Name: 6-nitro-3-[(4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl]quinazolin-4-one CAS Name: 6-nitro-3-[(4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl]-4-quinazolinone IUPAC Name: 6-nitro-3-[(4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl]quinazolin-4-one Traditional Name: 3-[(4-keto-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl]-6-nitro-quinazolin-4-one Formula: C17H12N5O4+ MolecularWeight: 350.30828

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+]2C(=C1)NC(=CC2=O)CN3C=NC4=C(C3=O)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=[N+]2C(=C1)NC(=CC2=O)CN3C=NC4=C(C3=O)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C17H11N5O4/c23-16-7-11(19-15-3-1-2-6-21(15)16)9-20-10-18-14-5-4-12(22(25)26)8-13(14)17(20)24/h1-8,10H,9H2/p+1