4-[(6-azanyl-1-methyl-3-phenyl-quinolin-1-ium-4-yl)amino]-N-[4-[(1-methylpyridin-1-ium-4-yl)amino]phenyl]benzamide dibromide

Systemtic Name: 4-[(6-azanyl-1-methyl-3-phenyl-quinolin-1-ium-4-yl)amino]-N-[4-[(1-methylpyridin-1-ium-4-yl)amino]phenyl]benzamide dibromide Openeye Name: 4-[(6-amino-1-methyl-3-phenyl-quinolin-1-ium-4-yl)amino]-N-[4-[(1-methylpyridin-1-ium-4-yl)amino]phenyl]benzamide dibromide CAS Name: 4-[(6-amino-1-methyl-3-phenyl-4-quinolin-1-iumyl)amino]-N-[4-[(1-methyl-4-pyridin-1-iumyl)amino]phenyl]benzamide dibromide IUPAC Name: 4-[(6-amino-1-methyl-3-phenylquinolin-1-ium-4-yl)amino]-N-[4-[(1-methylpyridin-1-ium-4-yl)amino]phenyl]benzamide dibromide Traditional Name: 4-[(6-amino-1-methyl-3-phenyl-quinolin-1-ium-4-yl)amino]-N-[4-[(1-methylpyridin-1-ium-4-yl)amino]phenyl]benzamide dibromide Formula: C35H32Br2N6O MolecularWeight: 712.47618

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)NC4=C5C=C(C=CC5=[N+](C=C4C6=CC=CC=C6)C)N.[Br-].[Br-]

Isomeric SMILES

C[N+]1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)NC4=C5C=C(C=CC5=[N+](C=C4C6=CC=CC=C6)C)N.[Br-].[Br-]

InChI

InChI=1S/C35H30N6O.2BrH/c1-40-20-18-30(19-21-40)37-27-13-15-29(16-14-27)39-35(42)25-8-11-28(12-9-25)38-34-31-22-26(36)10-17-33(31)41(2)23-32(34)24-6-4-3-5-7-24;;/h3-23H,36H2,1-2H3,(H,39,42);2*1H