[[3,5-dimethyl-4-(10-methylacridin-10-ium-9-yl)carbonyloxy-phenyl]carbonylamino]methanesulfonic acid bromide

Systemtic Name: [[3,5-dimethyl-4-(10-methylacridin-10-ium-9-yl)carbonyloxy-phenyl]carbonylamino]methanesulfonic acid bromide Openeye Name: [[3,5-dimethyl-4-(10-methylacridin-10-ium-9-carbonyl)oxy-benzoyl]amino]methanesulfonic acid bromide CAS Name: [[[3,5-dimethyl-4-[(10-methyl-9-acridin-10-iumyl)-oxomethoxy]phenyl]-oxomethyl]amino]methanesulfonic acid bromide IUPAC Name: [[3,5-dimethyl-4-(10-methylacridin-10-ium-9-carbonyl)oxybenzoyl]amino]methanesulfonic acid bromide Traditional Name: [[3,5-dimethyl-4-(10-methylacridin-10-ium-9-carbonyl)oxy-benzoyl]amino]methanesulfonic acid bromide Formula: C25H23BrN2O6S MolecularWeight: 559.42892

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC(=O)C2=C3C=CC=CC3=[N+](C4=CC=CC=C42)C)C)C(=O)NCS(=O)(=O)O.[Br-]

Isomeric SMILES

CC1=CC(=CC(=C1OC(=O)C2=C3C=CC=CC3=[N+](C4=CC=CC=C42)C)C)C(=O)NCS(=O)(=O)O.[Br-]

InChI

InChI=1S/C25H22N2O6S.BrH/c1-15-12-17(24(28)26-14-34(30,31)32)13-16(2)23(15)33-25(29)22-18-8-4-6-10-20(18)27(3)21-11-7-5-9-19(21)22;/h4-13H,14H2,1-3H3,(H-,26,28,30,31,32);1H