3,4,5-trimethoxy-2-[(2-methoxycarbonylthiophen-3-yl)sulfonylamino]benzoic acid

Systemtic Name: 3,4,5-trimethoxy-2-[(2-methoxycarbonylthiophen-3-yl)sulfonylamino]benzoic acid Openeye Name: 3,4,5-trimethoxy-2-[(2-methoxycarbonyl-3-thienyl)sulfonylamino]benzoic acid CAS Name: 3,4,5-trimethoxy-2-[(2-methoxycarbonyl-3-thiophenyl)sulfonylamino]benzoic acid IUPAC Name: 3,4,5-trimethoxy-2-[(2-methoxycarbonylthiophen-3-yl)sulfonylamino]benzoic acid Traditional Name: 2-[(2-carbomethoxy-3-thienyl)sulfonylamino]-3,4,5-trimethoxy-benzoic acid Formula: C16H17NO9S2 MolecularWeight: 431.43748

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)C(=O)O)NS(=O)(=O)C2=C(SC=C2)C(=O)OC)OC)OC

Isomeric SMILES

COC1=C(C(=C(C(=C1)C(=O)O)NS(=O)(=O)C2=C(SC=C2)C(=O)OC)OC)OC

InChI

InChI=1S/C16H17NO9S2/c1-23-9-7-8(15(18)19)11(13(25-3)12(9)24-2)17-28(21,22)10-5-6-27-14(10)16(20)26-4/h5-7,17H,1-4H3,(H,18,19)