4-(4-chloranylphenoxy)-3-(2,5-dihydropyrrol-1-yl)-5-sulfamoyl-benzoic acid

Systemtic Name: 4-(4-chloranylphenoxy)-3-(2,5-dihydropyrrol-1-yl)-5-sulfamoyl-benzoic acid Openeye Name: 4-(4-chlorophenoxy)-3-(2,5-dihydropyrrol-1-yl)-5-sulfamoyl-benzoic acid CAS Name: 4-(4-chlorophenoxy)-3-(2,5-dihydropyrrol-1-yl)-5-sulfamoylbenzoic acid IUPAC Name: 4-(4-chlorophenoxy)-3-(2,5-dihydropyrrol-1-yl)-5-sulfamoylbenzoic acid Traditional Name: 4-(4-chlorophenoxy)-3-(3-pyrrolin-1-yl)-5-sulfamoyl-benzoic acid Formula: C17H15ClN2O5S MolecularWeight: 394.8294

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CCN1C2=C(C(=CC(=C2)C(=O)O)S(=O)(=O)N)OC3=CC=C(C=C3)Cl

Isomeric SMILES

C1C=CCN1C2=C(C(=CC(=C2)C(=O)O)S(=O)(=O)N)OC3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H15ClN2O5S/c18-12-3-5-13(6-4-12)25-16-14(20-7-1-2-8-20)9-11(17(21)22)10-15(16)26(19,23)24/h1-6,9-10H,7-8H2,(H,21,22)(H2,19,23,24)