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

Systemtic Name: 1-[(5,11-dimethyl-9-oxidanyl-6H-pyrido[4,3-b]carbazol-2-ium-2-yl)oxy]-3-methoxy-propan-2-one bromide Openeye Name: 1-[(9-hydroxy-5,11-dimethyl-6H-pyrido[4,3-b]carbazol-2-ium-2-yl)oxy]-3-methoxy-propan-2-one bromide CAS Name: 1-[(9-hydroxy-5,11-dimethyl-6H-pyrido[4,3-b]carbazol-2-ium-2-yl)oxy]-3-methoxy-2-propanone bromide IUPAC Name: 1-[(9-hydroxy-5,11-dimethyl-6H-pyrido[4,3-b]carbazol-2-ium-2-yl)oxy]-3-methoxypropan-2-one bromide Traditional Name: 1-[(9-hydroxy-5,11-dimethyl-6H-pyrido[4,3-b]carbazol-2-ium-2-yl)oxy]-3-methoxy-acetone bromide Formula: C21H21BrN2O4 MolecularWeight: 445.30644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20N2O4.BrH/c1-12-18-9-23(27-11-15(25)10-26-3)7-6-16(18)13(2)21-20(12)17-8-14(24)4-5-19(17)22-21;/h4-9,24H,10-11H2,1-3H3;1H