(E)-2-diazonio-1-[4-[(2-methylpropan-2-yl)oxy]phenyl]-2-(4-methylsulfonyloxyphenyl)sulfonyl-ethenolate

Systemtic Name: (E)-2-diazonio-1-[4-[(2-methylpropan-2-yl)oxy]phenyl]-2-(4-methylsulfonyloxyphenyl)sulfonyl-ethenolate Openeye Name: (E)-1-(4-tert-butoxyphenyl)-2-diazonio-2-(4-methylsulfonyloxyphenyl)sulfonyl-ethenolate CAS Name: (E)-2-diazonio-1-[4-[(2-methylpropan-2-yl)oxy]phenyl]-2-(4-methylsulfonyloxyphenyl)sulfonylethenolate IUPAC Name: (E)-2-diazonio-1-[4-[(2-methylpropan-2-yl)oxy]phenyl]-2-(4-methylsulfonyloxyphenyl)sulfonylethenolate Traditional Name: (E)-1-(4-tert-butoxyphenyl)-2-diazonio-2-(4-methylsulfonyloxyphenyl)sulfonyl-ethenolate Formula: C19H20N2O7S2 MolecularWeight: 452.5013

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC1=CC=C(C=C1)C(=C([N+]#N)S(=O)(=O)C2=CC=C(C=C2)OS(=O)(=O)C)[O-]

Isomeric SMILES

CC(C)(C)OC1=CC=C(C=C1)/C(=C(/[N+]#N)\S(=O)(=O)C2=CC=C(C=C2)OS(=O)(=O)C)/[O-]

InChI

InChI=1S/C19H20N2O7S2/c1-19(2,3)27-14-7-5-13(6-8-14)17(22)18(21-20)30(25,26)16-11-9-15(10-12-16)28-29(4,23)24/h5-12H,1-4H3/b18-17+