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

Systemtic Name: (E)-2-diazonio-2-(4-ethylsulfonyloxyphenyl)sulfonyl-1-[4-[(2-methylpropan-2-yl)oxy]phenyl]ethenolate Openeye Name: (E)-1-(4-tert-butoxyphenyl)-2-diazonio-2-(4-ethylsulfonyloxyphenyl)sulfonyl-ethenolate CAS Name: (E)-2-diazonio-2-(4-ethylsulfonyloxyphenyl)sulfonyl-1-[4-[(2-methylpropan-2-yl)oxy]phenyl]ethenolate IUPAC Name: (E)-2-diazonio-2-(4-ethylsulfonyloxyphenyl)sulfonyl-1-[4-[(2-methylpropan-2-yl)oxy]phenyl]ethenolate Traditional Name: (E)-1-(4-tert-butoxyphenyl)-2-diazonio-2-(4-esyloxyphenyl)sulfonyl-ethenolate Formula: C20H22N2O7S2 MolecularWeight: 466.52788

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N2O7S2/c1-5-30(24,25)29-16-10-12-17(13-11-16)31(26,27)19(22-21)18(23)14-6-8-15(9-7-14)28-20(2,3)4/h6-13H,5H2,1-4H3/b19-18+