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

Systemtic Name: 3-(3,3-dimethylpyrrolidin-1-yl)-4-phenoxy-5-sulfamoyl-benzoic acid Openeye Name: 3-(3,3-dimethylpyrrolidin-1-yl)-4-phenoxy-5-sulfamoyl-benzoic acid CAS Name: 3-(3,3-dimethyl-1-pyrrolidinyl)-4-phenoxy-5-sulfamoylbenzoic acid IUPAC Name: 3-(3,3-dimethylpyrrolidin-1-yl)-4-phenoxy-5-sulfamoylbenzoic acid Traditional Name: 3-(3,3-dimethylpyrrolidino)-4-phenoxy-5-sulfamoyl-benzoic acid Formula: C19H22N2O5S MolecularWeight: 390.45338

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCN(C1)C2=C(C(=CC(=C2)C(=O)O)S(=O)(=O)N)OC3=CC=CC=C3)C

Isomeric SMILES

CC1(CCN(C1)C2=C(C(=CC(=C2)C(=O)O)S(=O)(=O)N)OC3=CC=CC=C3)C

InChI

InChI=1S/C19H22N2O5S/c1-19(2)8-9-21(12-19)15-10-13(18(22)23)11-16(27(20,24)25)17(15)26-14-6-4-3-5-7-14/h3-7,10-11H,8-9,12H2,1-2H3,(H,22,23)(H2,20,24,25)