2-(5,11-dimethyl-9-oxidanyl-6H-pyrido[4,3-b]carbazol-2-ium-2-yl)-6-methyl-oxane-3,4,5-triol ethanoate

Systemtic Name: 2-(5,11-dimethyl-9-oxidanyl-6H-pyrido[4,3-b]carbazol-2-ium-2-yl)-6-methyl-oxane-3,4,5-triol ethanoate Openeye Name: 2-(9-hydroxy-5,11-dimethyl-6H-pyrido[4,3-b]carbazol-2-ium-2-yl)-6-methyl-tetrahydropyran-3,4,5-triol acetate CAS Name: 2-(9-hydroxy-5,11-dimethyl-6H-pyrido[4,3-b]carbazol-2-ium-2-yl)-6-methyloxane-3,4,5-triol acetate IUPAC Name: 2-(9-hydroxy-5,11-dimethyl-6H-pyrido[4,3-b]carbazol-2-ium-2-yl)-6-methyloxane-3,4,5-triol acetate Traditional Name: 2-(9-hydroxy-5,11-dimethyl-6H-pyrido[4,3-b]carbazol-2-ium-2-yl)-6-methyl-tetrahydropyran-3,4,5-triol acetate Formula: C25H28N2O7 MolecularWeight: 468.49902

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(C(C(O1)[N+]2=CC3=C(C=C2)C(=C4C(=C3C)C5=C(N4)C=CC(=C5)O)C)O)O)O.CC(=O)[O-]

Isomeric SMILES

CC1C(C(C(C(O1)[N+]2=CC3=C(C=C2)C(=C4C(=C3C)C5=C(N4)C=CC(=C5)O)C)O)O)O.CC(=O)[O-]

InChI

InChI=1S/C23H24N2O5.C2H4O2/c1-10-16-9-25(23-22(29)21(28)20(27)12(3)30-23)7-6-14(16)11(2)19-18(10)15-8-13(26)4-5-17(15)24-19;1-2(3)4/h4-9,12,20-23,26-29H,1-3H3;1H3,(H,3,4)