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

Systemtic Name: 3-(3-chloranylpyrrolidin-1-yl)-4-phenoxy-5-sulfamoyl-benzoic acid Openeye Name: 3-(3-chloropyrrolidin-1-yl)-4-phenoxy-5-sulfamoyl-benzoic acid CAS Name: 3-(3-chloro-1-pyrrolidinyl)-4-phenoxy-5-sulfamoylbenzoic acid IUPAC Name: 3-(3-chloropyrrolidin-1-yl)-4-phenoxy-5-sulfamoylbenzoic acid Traditional Name: 3-(3-chloropyrrolidino)-4-phenoxy-5-sulfamoyl-benzoic acid Formula: C17H17ClN2O5S MolecularWeight: 396.84528

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1Cl)C2=C(C(=CC(=C2)C(=O)O)S(=O)(=O)N)OC3=CC=CC=C3

Isomeric SMILES

C1CN(CC1Cl)C2=C(C(=CC(=C2)C(=O)O)S(=O)(=O)N)OC3=CC=CC=C3

InChI

InChI=1S/C17H17ClN2O5S/c18-12-6-7-20(10-12)14-8-11(17(21)22)9-15(26(19,23)24)16(14)25-13-4-2-1-3-5-13/h1-5,8-9,12H,6-7,10H2,(H,21,22)(H2,19,23,24)