4-[(1,2-dimethylindazol-2-ium-3-yl)diazenyl]-N,N-diethyl-aniline; methyl sulfate

Systemtic Name: 4-[(1,2-dimethylindazol-2-ium-3-yl)diazenyl]-N,N-diethyl-aniline; methyl sulfate Openeye Name: 4-(1,2-dimethylindazol-2-ium-3-yl)azo-N,N-diethyl-aniline; methyl sulfate CAS Name: 4-[(1,2-dimethyl-3-indazol-2-iumyl)azo]-N,N-diethylaniline; methyl sulfate IUPAC Name: 4-[(1,2-dimethylindazol-2-ium-3-yl)diazenyl]-N,N-diethylaniline; methyl sulfate Traditional Name: [4-(1,2-dimethylindazol-2-ium-3-yl)azophenyl]-diethyl-amine; methyl sulfate Formula: C20H27N5O4S MolecularWeight: 433.52448

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)N=NC2=[N+](N(C3=CC=CC=C32)C)C.COS(=O)(=O)[O-]

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)N=NC2=[N+](N(C3=CC=CC=C32)C)C.COS(=O)(=O)[O-]

InChI

InChI=1S/C19H24N5.CH4O4S/c1-5-24(6-2)16-13-11-15(12-14-16)20-21-19-17-9-7-8-10-18(17)22(3)23(19)4;1-5-6(2,3)4/h7-14H,5-6H2,1-4H3;1H3,(H,2,3,4)/q+1;/p-1