8-(1,3-benzodioxol-5-yl)-6-[(1-oxidanidylpyridin-1-ium-4-yl)methyl]pyrido[2,3-d]pyridazin-5-one

Systemtic Name: 8-(1,3-benzodioxol-5-yl)-6-[(1-oxidanidylpyridin-1-ium-4-yl)methyl]pyrido[2,3-d]pyridazin-5-one Openeye Name: 8-(1,3-benzodioxol-5-yl)-6-[(1-oxidopyridin-1-ium-4-yl)methyl]pyrido[2,3-d]pyridazin-5-one CAS Name: 8-(1,3-benzodioxol-5-yl)-6-[(1-oxido-4-pyridin-1-iumyl)methyl]-5-pyrido[2,3-d]pyridazinone IUPAC Name: 8-(1,3-benzodioxol-5-yl)-6-[(1-oxidopyridin-1-ium-4-yl)methyl]pyrido[2,3-d]pyridazin-5-one Traditional Name: 8-(1,3-benzodioxol-5-yl)-6-[(1-oxidopyridin-1-ium-4-yl)methyl]pyrido[2,3-d]pyridazin-5-one Formula: C20H14N4O4 MolecularWeight: 374.34956

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=NN(C(=O)C4=C3N=CC=C4)CC5=CC=[N+](C=C5)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=NN(C(=O)C4=C3N=CC=C4)CC5=CC=[N+](C=C5)[O-]

InChI

InChI=1S/C20H14N4O4/c25-20-15-2-1-7-21-19(15)18(14-3-4-16-17(10-14)28-12-27-16)22-24(20)11-13-5-8-23(26)9-6-13/h1-10H,11-12H2