3-[(2-methoxycarbonylthiophen-3-yl)sulfonylamino]benzoic acid

Systemtic Name: 3-[(2-methoxycarbonylthiophen-3-yl)sulfonylamino]benzoic acid Openeye Name: 3-[(2-methoxycarbonyl-3-thienyl)sulfonylamino]benzoic acid CAS Name: 3-[(2-methoxycarbonyl-3-thiophenyl)sulfonylamino]benzoic acid IUPAC Name: 3-[(2-methoxycarbonylthiophen-3-yl)sulfonylamino]benzoic acid Traditional Name: 3-[(2-carbomethoxy-3-thienyl)sulfonylamino]benzoic acid Formula: C13H11NO6S2 MolecularWeight: 341.35954

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)S(=O)(=O)NC2=CC=CC(=C2)C(=O)O

Isomeric SMILES

COC(=O)C1=C(C=CS1)S(=O)(=O)NC2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C13H11NO6S2/c1-20-13(17)11-10(5-6-21-11)22(18,19)14-9-4-2-3-8(7-9)12(15)16/h2-7,14H,1H3,(H,15,16)