[carboxysulfanyl-(2-methylphenyl)sulfonyl-amino]sulfanylmethanoic acid

Systemtic Name: [carboxysulfanyl-(2-methylphenyl)sulfonyl-amino]sulfanylmethanoic acid Openeye Name: [carboxysulfanyl(o-tolylsulfonyl)amino]sulfanylformic acid CAS Name: [[(carboxythio)-(2-methylphenyl)sulfonylamino]thio]formic acid IUPAC Name: [carboxysulfanyl-(2-methylphenyl)sulfonylamino]sulfanylformic acid Traditional Name: [[(carboxythio)-(o-tolylsulfonyl)amino]thio]formic acid Formula: C9H9NO6S3 MolecularWeight: 323.36586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1S(=O)(=O)N(SC(=O)O)SC(=O)O

Isomeric SMILES

CC1=CC=CC=C1S(=O)(=O)N(SC(=O)O)SC(=O)O

InChI

InChI=1S/C9H9NO6S3/c1-6-4-2-3-5-7(6)19(15,16)10(17-8(11)12)18-9(13)14/h2-5H,1H3,(H,11,12)(H,13,14)