8-(3-nitrophenyl)-6-[(1-oxidanidylpyridin-1-ium-2-yl)methyl]pyrido[2,3-d]pyridazin-5-one

Systemtic Name: 8-(3-nitrophenyl)-6-[(1-oxidanidylpyridin-1-ium-2-yl)methyl]pyrido[2,3-d]pyridazin-5-one Openeye Name: 8-(3-nitrophenyl)-6-[(1-oxidopyridin-1-ium-2-yl)methyl]pyrido[2,3-d]pyridazin-5-one CAS Name: 8-(3-nitrophenyl)-6-[(1-oxido-2-pyridin-1-iumyl)methyl]-5-pyrido[2,3-d]pyridazinone IUPAC Name: 8-(3-nitrophenyl)-6-[(1-oxidopyridin-1-ium-2-yl)methyl]pyrido[2,3-d]pyridazin-5-one Traditional Name: 8-(3-nitrophenyl)-6-[(1-oxidopyridin-1-ium-2-yl)methyl]pyrido[2,3-d]pyridazin-5-one Formula: C19H13N5O4 MolecularWeight: 375.33762

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C(=C1)CN2C(=O)C3=C(C(=N2)C4=CC(=CC=C4)[N+](=O)[O-])N=CC=C3)[O-]

Isomeric SMILES

C1=CC=[N+](C(=C1)CN2C(=O)C3=C(C(=N2)C4=CC(=CC=C4)[N+](=O)[O-])N=CC=C3)[O-]

InChI

InChI=1S/C19H13N5O4/c25-19-16-8-4-9-20-18(16)17(13-5-3-7-14(11-13)24(27)28)21-22(19)12-15-6-1-2-10-23(15)26/h1-11H,12H2