7-(carboxymethyloxy)-4-(carboxymethylsulfamoyl)-1-benzofuran-2-carboxylic acid

Systemtic Name: 7-(carboxymethyloxy)-4-(carboxymethylsulfamoyl)-1-benzofuran-2-carboxylic acid Openeye Name: 7-(carboxymethyloxy)-4-(carboxymethylsulfamoyl)benzofuran-2-carboxylic acid CAS Name: 7-(carboxymethyloxy)-4-(carboxymethylsulfamoyl)-2-benzofurancarboxylic acid IUPAC Name: 7-(carboxymethyloxy)-4-(carboxymethylsulfamoyl)-1-benzofuran-2-carboxylic acid Traditional Name: 7-(carboxymethyloxy)-4-(carboxymethylsulfamoyl)coumarilic acid Formula: C13H11NO10S MolecularWeight: 373.29214

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C=C(OC2=C1OCC(=O)O)C(=O)O)S(=O)(=O)NCC(=O)O

Isomeric SMILES

C1=CC(=C2C=C(OC2=C1OCC(=O)O)C(=O)O)S(=O)(=O)NCC(=O)O

InChI

InChI=1S/C13H11NO10S/c15-10(16)4-14-25(21,22)9-2-1-7(23-5-11(17)18)12-6(9)3-8(24-12)13(19)20/h1-3,14H,4-5H2,(H,15,16)(H,17,18)(H,19,20)