(1,2-dimethylindol-3-yl)-(1,2-dimethyl-3-phenyl-imidazol-1-ium-4-yl)diazene; methyl sulfate

Systemtic Name: (1,2-dimethylindol-3-yl)-(1,2-dimethyl-3-phenyl-imidazol-1-ium-4-yl)diazene; methyl sulfate Openeye Name: (1,2-dimethylindol-3-yl)-(1,2-dimethyl-3-phenyl-imidazol-1-ium-4-yl)diazene; methyl sulfate CAS Name: (1,2-dimethyl-3-indolyl)-(1,2-dimethyl-3-phenyl-4-imidazol-1-iumyl)diazene; methyl sulfate IUPAC Name: (1,2-dimethylindol-3-yl)-(1,2-dimethyl-3-phenylimidazol-1-ium-4-yl)diazene; methyl sulfate Traditional Name: (1,2-dimethylindol-3-yl)-(1,2-dimethyl-3-phenyl-imidazol-1-ium-4-yl)diazene; methyl sulfate Formula: C22H25N5O4S MolecularWeight: 455.53

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1C)N=NC3=C[N+](=C(N3C4=CC=CC=C4)C)C.COS(=O)(=O)[O-]

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1C)N=NC3=C[N+](=C(N3C4=CC=CC=C4)C)C.COS(=O)(=O)[O-]

InChI

InChI=1S/C21H22N5.CH4O4S/c1-15-21(18-12-8-9-13-19(18)25(15)4)23-22-20-14-24(3)16(2)26(20)17-10-6-5-7-11-17;1-5-6(2,3)4/h5-14H,1-4H3;1H3,(H,2,3,4)/q+1;/p-1