3,5-dimethyl-4-(10-methylacridin-10-ium-9-yl)carbonyloxy-benzoic acid bromide

Systemtic Name: 3,5-dimethyl-4-(10-methylacridin-10-ium-9-yl)carbonyloxy-benzoic acid bromide Openeye Name: 3,5-dimethyl-4-(10-methylacridin-10-ium-9-carbonyl)oxy-benzoic acid bromide CAS Name: 3,5-dimethyl-4-[(10-methyl-9-acridin-10-iumyl)-oxomethoxy]benzoic acid bromide IUPAC Name: 3,5-dimethyl-4-(10-methylacridin-10-ium-9-carbonyl)oxybenzoic acid bromide Traditional Name: 3,5-dimethyl-4-(10-methylacridin-10-ium-9-carbonyl)oxy-benzoic acid bromide Formula: C24H20BrNO4 MolecularWeight: 466.3239

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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)O.[Br-]

Isomeric SMILES

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

InChI

InChI=1S/C24H19NO4.BrH/c1-14-12-16(23(26)27)13-15(2)22(14)29-24(28)21-17-8-4-6-10-19(17)25(3)20-11-7-5-9-18(20)21;/h4-13H,1-3H3;1H