4-(4-methoxyphenoxy)-3-(2-methylpyrrolidin-1-yl)-5-sulfamoyl-benzoic acid

Systemtic Name: 4-(4-methoxyphenoxy)-3-(2-methylpyrrolidin-1-yl)-5-sulfamoyl-benzoic acid Openeye Name: 4-(4-methoxyphenoxy)-3-(2-methylpyrrolidin-1-yl)-5-sulfamoyl-benzoic acid CAS Name: 4-(4-methoxyphenoxy)-3-(2-methyl-1-pyrrolidinyl)-5-sulfamoylbenzoic acid IUPAC Name: 4-(4-methoxyphenoxy)-3-(2-methylpyrrolidin-1-yl)-5-sulfamoylbenzoic acid Traditional Name: 4-(4-methoxyphenoxy)-3-(2-methylpyrrolidino)-5-sulfamoyl-benzoic acid Formula: C19H22N2O6S MolecularWeight: 406.45278

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN1C2=C(C(=CC(=C2)C(=O)O)S(=O)(=O)N)OC3=CC=C(C=C3)OC

Isomeric SMILES

CC1CCCN1C2=C(C(=CC(=C2)C(=O)O)S(=O)(=O)N)OC3=CC=C(C=C3)OC

InChI

InChI=1S/C19H22N2O6S/c1-12-4-3-9-21(12)16-10-13(19(22)23)11-17(28(20,24)25)18(16)27-15-7-5-14(26-2)6-8-15/h5-8,10-12H,3-4,9H2,1-2H3,(H,22,23)(H2,20,24,25)