3-(2,5-dimethylpyrrol-1-yl)-4-phenoxy-5-sulfamoyl-benzoic acid

Systemtic Name: 3-(2,5-dimethylpyrrol-1-yl)-4-phenoxy-5-sulfamoyl-benzoic acid Openeye Name: 3-(2,5-dimethylpyrrol-1-yl)-4-phenoxy-5-sulfamoyl-benzoic acid CAS Name: 3-(2,5-dimethyl-1-pyrrolyl)-4-phenoxy-5-sulfamoylbenzoic acid IUPAC Name: 3-(2,5-dimethylpyrrol-1-yl)-4-phenoxy-5-sulfamoylbenzoic acid Traditional Name: 3-(2,5-dimethylpyrrol-1-yl)-4-phenoxy-5-sulfamoyl-benzoic acid Formula: C19H18N2O5S MolecularWeight: 386.42162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=C(C(=CC(=C2)C(=O)O)S(=O)(=O)N)OC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC=C(N1C2=C(C(=CC(=C2)C(=O)O)S(=O)(=O)N)OC3=CC=CC=C3)C

InChI

InChI=1S/C19H18N2O5S/c1-12-8-9-13(2)21(12)16-10-14(19(22)23)11-17(27(20,24)25)18(16)26-15-6-4-3-5-7-15/h3-11H,1-2H3,(H,22,23)(H2,20,24,25)