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3-[3,4-bis(oxidanyl)butylamino]-4-phenoxy-5-sulfamoyl-benzoic acid

3-[3,4-bis(oxidanyl)butylamino]-4-phenoxy-5-sulfamoyl-benzoic acid

Systemtic Name:3-[3,4-bis(oxidanyl)butylamino]-4-phenoxy-5-sulfamoyl-benzoic acid
Openeye Name:3-(3,4-dihydroxybutylamino)-4-phenoxy-5-sulfamoyl-benzoic acid
CAS Name:3-(3,4-dihydroxybutylamino)-4-phenoxy-5-sulfamoylbenzoic acid
IUPAC Name:3-(3,4-dihydroxybutylamino)-4-phenoxy-5-sulfamoylbenzoic acid
Traditional Name:3-(3,4-dihydroxybutylamino)-4-phenoxy-5-sulfamoyl-benzoic acid
Formula: C17H20N2O7S
MolecularWeight: 396.4149
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=C(C=C(C=C2S(=O)(=O)N)C(=O)O)NCCC(CO)O


Isomeric SMILES

C1=CC=C(C=C1)OC2=C(C=C(C=C2S(=O)(=O)N)C(=O)O)NCCC(CO)O


InChI

InChI=1S/C17H20N2O7S/c18-27(24,25)15-9-11(17(22)23)8-14(19-7-6-12(21)10-20)16(15)26-13-4-2-1-3-5-13/h1-5,8-9,12,19-21H,6-7,10H2,(H,22,23)(H2,18,24,25)


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