3-(2-ethylpyrrolidin-1-yl)-4-(3-methylphenoxy)-5-sulfamoyl-benzoic acid

Systemtic Name: 3-(2-ethylpyrrolidin-1-yl)-4-(3-methylphenoxy)-5-sulfamoyl-benzoic acid Openeye Name: 3-(2-ethylpyrrolidin-1-yl)-4-(3-methylphenoxy)-5-sulfamoyl-benzoic acid CAS Name: 3-(2-ethyl-1-pyrrolidinyl)-4-(3-methylphenoxy)-5-sulfamoylbenzoic acid IUPAC Name: 3-(2-ethylpyrrolidin-1-yl)-4-(3-methylphenoxy)-5-sulfamoylbenzoic acid Traditional Name: 3-(2-ethylpyrrolidino)-4-(3-methylphenoxy)-5-sulfamoyl-benzoic acid Formula: C20H24N2O5S MolecularWeight: 404.47996

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCN1C2=C(C(=CC(=C2)C(=O)O)S(=O)(=O)N)OC3=CC=CC(=C3)C

Isomeric SMILES

CCC1CCCN1C2=C(C(=CC(=C2)C(=O)O)S(=O)(=O)N)OC3=CC=CC(=C3)C

InChI

InChI=1S/C20H24N2O5S/c1-3-15-7-5-9-22(15)17-11-14(20(23)24)12-18(28(21,25)26)19(17)27-16-8-4-6-13(2)10-16/h4,6,8,10-12,15H,3,5,7,9H2,1-2H3,(H,23,24)(H2,21,25,26)