N,N-dimethyl-4-[(1-methylpyridin-1-ium-2-yl)diazenyl]aniline; methyl sulfate

Systemtic Name: N,N-dimethyl-4-[(1-methylpyridin-1-ium-2-yl)diazenyl]aniline; methyl sulfate Openeye Name: N,N-dimethyl-4-(1-methylpyridin-1-ium-2-yl)azo-aniline; methyl sulfate CAS Name: N,N-dimethyl-4-[(1-methyl-2-pyridin-1-iumyl)azo]aniline; methyl sulfate IUPAC Name: N,N-dimethyl-4-[(1-methylpyridin-1-ium-2-yl)diazenyl]aniline; methyl sulfate Traditional Name: dimethyl-[4-(1-methylpyridin-1-ium-2-yl)azophenyl]amine; methyl sulfate Formula: C15H20N4O4S MolecularWeight: 352.4087

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=CC=C1N=NC2=CC=C(C=C2)N(C)C.COS(=O)(=O)[O-]

Isomeric SMILES

C[N+]1=CC=CC=C1N=NC2=CC=C(C=C2)N(C)C.COS(=O)(=O)[O-]

InChI

InChI=1S/C14H17N4.CH4O4S/c1-17(2)13-9-7-12(8-10-13)15-16-14-6-4-5-11-18(14)3;1-5-6(2,3)4/h4-11H,1-3H3;1H3,(H,2,3,4)/q+1;/p-1