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

Systemtic Name: 8-(3-bromophenyl)-6-[(1-oxidanidylpyridin-1-ium-4-yl)methyl]pyrido[2,3-d]pyridazin-5-one Openeye Name: 8-(3-bromophenyl)-6-[(1-oxidopyridin-1-ium-4-yl)methyl]pyrido[2,3-d]pyridazin-5-one CAS Name: 8-(3-bromophenyl)-6-[(1-oxido-4-pyridin-1-iumyl)methyl]-5-pyrido[2,3-d]pyridazinone IUPAC Name: 8-(3-bromophenyl)-6-[(1-oxidopyridin-1-ium-4-yl)methyl]pyrido[2,3-d]pyridazin-5-one Traditional Name: 8-(3-bromophenyl)-6-[(1-oxidopyridin-1-ium-4-yl)methyl]pyrido[2,3-d]pyridazin-5-one Formula: C19H13BrN4O2 MolecularWeight: 409.23612

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)C2=NN(C(=O)C3=C2N=CC=C3)CC4=CC=[N+](C=C4)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)Br)C2=NN(C(=O)C3=C2N=CC=C3)CC4=CC=[N+](C=C4)[O-]

InChI

InChI=1S/C19H13BrN4O2/c20-15-4-1-3-14(11-15)17-18-16(5-2-8-21-18)19(25)24(22-17)12-13-6-9-23(26)10-7-13/h1-11H,12H2