[4-[diazo-[4-[(2-methylpropan-2-yl)oxy]phenyl]sulfonyl-methyl]sulfonylphenyl] ethanesulfonate

Systemtic Name: [4-[diazo-[4-[(2-methylpropan-2-yl)oxy]phenyl]sulfonyl-methyl]sulfonylphenyl] ethanesulfonate Openeye Name: [4-[(4-tert-butoxyphenyl)sulfonyl-diazo-methyl]sulfonylphenyl] ethanesulfonate CAS Name: ethanesulfonic acid [4-[diazo-[4-[(2-methylpropan-2-yl)oxy]phenyl]sulfonylmethyl]sulfonylphenyl] ester IUPAC Name: [4-[diazo-[4-[(2-methylpropan-2-yl)oxy]phenyl]sulfonylmethyl]sulfonylphenyl] ethanesulfonate Traditional Name: ethanesulfonic acid [4-[(4-tert-butoxyphenyl)sulfonyl-diazo-methyl]sulfonylphenyl] ester Formula: C19H22N2O8S3 MolecularWeight: 502.58158

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22N2O8S3/c1-5-30(22,23)29-15-8-12-17(13-9-15)32(26,27)18(21-20)31(24,25)16-10-6-14(7-11-16)28-19(2,3)4/h6-13H,5H2,1-4H3