N-[4-[2-(3-methylphenyl)imidazo[1,2-b]pyridazin-3-yl]pyridin-2-yl]-1-oxidanidyl-quinolin-1-ium-6-carboxamide

Systemtic Name: N-[4-[2-(3-methylphenyl)imidazo[1,2-b]pyridazin-3-yl]pyridin-2-yl]-1-oxidanidyl-quinolin-1-ium-6-carboxamide Openeye Name: N-[4-[2-(m-tolyl)imidazo[1,2-b]pyridazin-3-yl]-2-pyridyl]-1-oxido-quinolin-1-ium-6-carboxamide CAS Name: N-[4-[2-(3-methylphenyl)-3-imidazo[1,2-b]pyridazinyl]-2-pyridinyl]-1-oxido-6-quinolin-1-iumcarboxamide IUPAC Name: N-[4-[2-(3-methylphenyl)imidazo[1,2-b]pyridazin-3-yl]pyridin-2-yl]-1-oxidoquinolin-1-ium-6-carboxamide Traditional Name: N-[4-[2-(m-tolyl)imidazo[1,2-b]pyridazin-3-yl]-2-pyridyl]-1-oxido-quinolin-1-ium-6-carboxamide Formula: C28H20N6O2 MolecularWeight: 472.4974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=C(N3C(=N2)C=CC=N3)C4=CC(=NC=C4)NC(=O)C5=CC6=C(C=C5)[N+](=CC=C6)[O-]

Isomeric SMILES

CC1=CC=CC(=C1)C2=C(N3C(=N2)C=CC=N3)C4=CC(=NC=C4)NC(=O)C5=CC6=C(C=C5)[N+](=CC=C6)[O-]

InChI

InChI=1S/C28H20N6O2/c1-18-5-2-6-20(15-18)26-27(34-25(32-26)8-3-12-30-34)21-11-13-29-24(17-21)31-28(35)22-9-10-23-19(16-22)7-4-14-33(23)36/h2-17H,1H3,(H,29,31,35)