(E)-2-diazonio-1-(2,4-dimethylphenyl)-2-(4-methylsulfonyloxyphenyl)sulfonyl-ethenolate

Systemtic Name: (E)-2-diazonio-1-(2,4-dimethylphenyl)-2-(4-methylsulfonyloxyphenyl)sulfonyl-ethenolate Openeye Name: (E)-2-diazonio-1-(2,4-dimethylphenyl)-2-(4-methylsulfonyloxyphenyl)sulfonyl-ethenolate CAS Name: (E)-2-diazonio-1-(2,4-dimethylphenyl)-2-(4-methylsulfonyloxyphenyl)sulfonylethenolate IUPAC Name: (E)-2-diazonio-1-(2,4-dimethylphenyl)-2-(4-methylsulfonyloxyphenyl)sulfonylethenolate Traditional Name: (E)-2-diazonio-1-(2,4-dimethylphenyl)-2-(4-methylsulfonyloxyphenyl)sulfonyl-ethenolate Formula: C17H16N2O6S2 MolecularWeight: 408.44874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=C([N+]#N)S(=O)(=O)C2=CC=C(C=C2)OS(=O)(=O)C)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)/C(=C(/[N+]#N)\S(=O)(=O)C2=CC=C(C=C2)OS(=O)(=O)C)/[O-])C

InChI

InChI=1S/C17H16N2O6S2/c1-11-4-9-15(12(2)10-11)16(20)17(19-18)27(23,24)14-7-5-13(6-8-14)25-26(3,21)22/h4-10H,1-3H3/b17-16+