1-methyl-6-(1-methylquinolin-1-ium-6-yl)quinolin-1-ium; methyl sulfate

Systemtic Name: 1-methyl-6-(1-methylquinolin-1-ium-6-yl)quinolin-1-ium; methyl sulfate Openeye Name: 1-methyl-6-(1-methylquinolin-1-ium-6-yl)quinolin-1-ium; methyl sulfate CAS Name: 1-methyl-6-(1-methyl-6-quinolin-1-iumyl)quinolin-1-ium; methyl sulfate IUPAC Name: 1-methyl-6-(1-methylquinolin-1-ium-6-yl)quinolin-1-ium; methyl sulfate Traditional Name: 1-methyl-6-(1-methylquinolin-1-ium-6-yl)quinolin-1-ium; methyl sulfate Formula: C22H24N2O8S2 MolecularWeight: 508.56456

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=CC2=C1C=CC(=C2)C3=CC4=C(C=C3)[N+](=CC=C4)C.COS(=O)(=O)[O-].COS(=O)(=O)[O-]

Isomeric SMILES

C[N+]1=CC=CC2=C1C=CC(=C2)C3=CC4=C(C=C3)[N+](=CC=C4)C.COS(=O)(=O)[O-].COS(=O)(=O)[O-]

InChI

InChI=1S/C20H18N2.2CH4O4S/c1-21-11-3-5-17-13-15(7-9-19(17)21)16-8-10-20-18(14-16)6-4-12-22(20)2;2*1-5-6(2,3)4/h3-14H,1-2H3;2*1H3,(H,2,3,4)/q+2;;/p-2