(4-chlorophenyl)-(1,3-dimethyl-1,2-dihydroimidazol-1-ium-2-yl)diazene; methyl sulfate

Systemtic Name: (4-chlorophenyl)-(1,3-dimethyl-1,2-dihydroimidazol-1-ium-2-yl)diazene; methyl sulfate Openeye Name: (4-chlorophenyl)-(1,3-dimethyl-1,2-dihydroimidazol-1-ium-2-yl)diazene; methyl sulfate CAS Name: (4-chlorophenyl)-(1,3-dimethyl-1,2-dihydroimidazol-1-ium-2-yl)diazene; methyl sulfate IUPAC Name: (4-chlorophenyl)-(1,3-dimethyl-1,2-dihydroimidazol-1-ium-2-yl)diazene; methyl sulfate Traditional Name: (4-chlorophenyl)-(1,3-dimethyl-4-imidazolin-1-ium-2-yl)diazene; methyl sulfate Formula: C12H17ClN4O4S MolecularWeight: 348.80578

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13ClN4.CH4O4S/c1-15-7-8-16(2)11(15)14-13-10-5-3-9(12)4-6-10;1-5-6(2,3)4/h3-8,11H,1-2H3;1H3,(H,2,3,4)