5-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxidanylidene-ethyl]-ethyl-sulfamoyl]thiophene-3-carboxylic acid

Systemtic Name: 5-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxidanylidene-ethyl]-ethyl-sulfamoyl]thiophene-3-carboxylic acid Openeye Name: 5-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxo-ethyl]-ethyl-sulfamoyl]thiophene-3-carboxylic acid CAS Name: 5-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl]-ethylsulfamoyl]-3-thiophenecarboxylic acid IUPAC Name: 5-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl]-ethylsulfamoyl]thiophene-3-carboxylic acid Traditional Name: 5-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-keto-ethyl]-ethyl-sulfamoyl]-3-thenoic acid Formula: C17H18N2O7S2 MolecularWeight: 426.46402

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NC1=CC2=C(C=C1)OCCO2)S(=O)(=O)C3=CC(=CS3)C(=O)O

Isomeric SMILES

CCN(CC(=O)NC1=CC2=C(C=C1)OCCO2)S(=O)(=O)C3=CC(=CS3)C(=O)O

InChI

InChI=1S/C17H18N2O7S2/c1-2-19(28(23,24)16-7-11(10-27-16)17(21)22)9-15(20)18-12-3-4-13-14(8-12)26-6-5-25-13/h3-4,7-8,10H,2,5-6,9H2,1H3,(H,18,20)(H,21,22)