1-[(5,11-dimethyl-9-oxidanyl-6H-pyrido[4,3-b]carbazol-2-ium-2-yl)oxy]-3-oxidanyl-propan-2-one bromide

Systemtic Name: 1-[(5,11-dimethyl-9-oxidanyl-6H-pyrido[4,3-b]carbazol-2-ium-2-yl)oxy]-3-oxidanyl-propan-2-one bromide Openeye Name: 1-hydroxy-3-[(9-hydroxy-5,11-dimethyl-6H-pyrido[4,3-b]carbazol-2-ium-2-yl)oxy]propan-2-one bromide CAS Name: 1-hydroxy-3-[(9-hydroxy-5,11-dimethyl-6H-pyrido[4,3-b]carbazol-2-ium-2-yl)oxy]-2-propanone bromide IUPAC Name: 1-hydroxy-3-[(9-hydroxy-5,11-dimethyl-6H-pyrido[4,3-b]carbazol-2-ium-2-yl)oxy]propan-2-one bromide Traditional Name: 1-hydroxy-3-[(9-hydroxy-5,11-dimethyl-6H-pyrido[4,3-b]carbazol-2-ium-2-yl)oxy]acetone bromide Formula: C20H19BrN2O4 MolecularWeight: 431.27986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C3=C1C=C[N+](=C3)OCC(=O)CO)C)C4=C(N2)C=CC(=C4)O.[Br-]

Isomeric SMILES

CC1=C2C(=C(C3=C1C=C[N+](=C3)OCC(=O)CO)C)C4=C(N2)C=CC(=C4)O.[Br-]

InChI

InChI=1S/C20H18N2O4.BrH/c1-11-17-8-22(26-10-14(25)9-23)6-5-15(17)12(2)20-19(11)16-7-13(24)3-4-18(16)21-20;/h3-8,23-24H,9-10H2,1-2H3;1H