5-(carboxymethylsulfanylcarbothioylamino)-2-oxidanyl-benzoic acid

Systemtic Name: 5-(carboxymethylsulfanylcarbothioylamino)-2-oxidanyl-benzoic acid Openeye Name: 5-(carboxymethylsulfanylcarbothioylamino)-2-hydroxy-benzoic acid CAS Name: 5-[[(carboxymethylthio)-sulfanylidenemethyl]amino]-2-hydroxybenzoic acid IUPAC Name: 5-(carboxymethylsulfanylcarbothioylamino)-2-hydroxybenzoic acid Traditional Name: 5-[(carboxymethylthio)carbothioylamino]-2-hydroxy-benzoic acid Formula: C10H9NO5S2 MolecularWeight: 287.31216

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC(=S)SCC(=O)O)C(=O)O)O

Isomeric SMILES

C1=CC(=C(C=C1NC(=S)SCC(=O)O)C(=O)O)O

InChI

InChI=1S/C10H9NO5S2/c12-7-2-1-5(3-6(7)9(15)16)11-10(17)18-4-8(13)14/h1-3,12H,4H2,(H,11,17)(H,13,14)(H,15,16)