5,12-dimethylquinolino[3,4-b][1,4]benzothiazin-5-ium; methyl sulfate

Systemtic Name: 5,12-dimethylquinolino[3,4-b][1,4]benzothiazin-5-ium; methyl sulfate Openeye Name: 5,12-dimethylquinolino[3,4-b][1,4]benzothiazin-5-ium; methyl sulfate CAS Name: 5,12-dimethylquinolino[3,4-b][1,4]benzothiazin-5-ium; methyl sulfate IUPAC Name: 5,12-dimethylquinolino[3,4-b][1,4]benzothiazin-5-ium; methyl sulfate Traditional Name: 5,12-dimethylquinolino[3,4-b][1,4]benzothiazin-5-ium; methyl sulfate Formula: C18H18N2O4S2 MolecularWeight: 390.47652

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2SC3=C1C4=CC=CC=C4[N+](=C3)C.COS(=O)(=O)[O-]

Isomeric SMILES

CN1C2=CC=CC=C2SC3=C1C4=CC=CC=C4[N+](=C3)C.COS(=O)(=O)[O-]

InChI

InChI=1S/C17H15N2S.CH4O4S/c1-18-11-16-17(12-7-3-4-8-13(12)18)19(2)14-9-5-6-10-15(14)20-16;1-5-6(2,3)4/h3-11H,1-2H3;1H3,(H,2,3,4)/q+1;/p-1