4-[4-(dimethylamino)phenoxy]-3-pyrrolidin-1-yl-5-sulfamoyl-benzoic acid

Systemtic Name: 4-[4-(dimethylamino)phenoxy]-3-pyrrolidin-1-yl-5-sulfamoyl-benzoic acid Openeye Name: 4-[4-(dimethylamino)phenoxy]-3-pyrrolidin-1-yl-5-sulfamoyl-benzoic acid CAS Name: 4-[4-(dimethylamino)phenoxy]-3-(1-pyrrolidinyl)-5-sulfamoylbenzoic acid IUPAC Name: 4-[4-(dimethylamino)phenoxy]-3-pyrrolidin-1-yl-5-sulfamoylbenzoic acid Traditional Name: 4-[4-(dimethylamino)phenoxy]-3-pyrrolidino-5-sulfamoyl-benzoic acid Formula: C19H23N3O5S MolecularWeight: 405.46802

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)OC2=C(C=C(C=C2S(=O)(=O)N)C(=O)O)N3CCCC3

Isomeric SMILES

CN(C)C1=CC=C(C=C1)OC2=C(C=C(C=C2S(=O)(=O)N)C(=O)O)N3CCCC3

InChI

InChI=1S/C19H23N3O5S/c1-21(2)14-5-7-15(8-6-14)27-18-16(22-9-3-4-10-22)11-13(19(23)24)12-17(18)28(20,25)26/h5-8,11-12H,3-4,9-10H2,1-2H3,(H,23,24)(H2,20,25,26)