5,11-dimethyl-2-(2-piperidin-1-ium-1-ylethyl)-6H-pyrido[4,3-b]carbazol-2-ium-9-ol; methanesulfonate

Systemtic Name: 5,11-dimethyl-2-(2-piperidin-1-ium-1-ylethyl)-6H-pyrido[4,3-b]carbazol-2-ium-9-ol; methanesulfonate Openeye Name: 5,11-dimethyl-2-(2-piperidin-1-ium-1-ylethyl)-6H-pyrido[4,3-b]carbazol-2-ium-9-ol; methanesulfonate CAS Name: 5,11-dimethyl-2-[2-(1-piperidin-1-iumyl)ethyl]-6H-pyrido[4,3-b]carbazol-2-ium-9-ol; methanesulfonate IUPAC Name: 5,11-dimethyl-2-(2-piperidin-1-ium-1-ylethyl)-6H-pyrido[4,3-b]carbazol-2-ium-9-ol; methanesulfonate Traditional Name: 5,11-dimethyl-2-(2-piperidin-1-ium-1-ylethyl)-6H-pyrido[4,3-b]carbazol-2-ium-9-ol dimesylate Formula: C26H35N3O7S2 MolecularWeight: 565.702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C3=C1C=C[N+](=C3)CC[NH+]4CCCCC4)C)C5=C(N2)C=CC(=C5)O.CS(=O)(=O)[O-].CS(=O)(=O)[O-]

Isomeric SMILES

CC1=C2C(=C(C3=C1C=C[N+](=C3)CC[NH+]4CCCCC4)C)C5=C(N2)C=CC(=C5)O.CS(=O)(=O)[O-].CS(=O)(=O)[O-]

InChI

InChI=1S/C24H27N3O.2CH4O3S/c1-16-21-15-27(13-12-26-9-4-3-5-10-26)11-8-19(21)17(2)24-23(16)20-14-18(28)6-7-22(20)25-24;2*1-5(2,3)4/h6-8,11,14-15,28H,3-5,9-10,12-13H2,1-2H3;2*1H3,(H,2,3,4)