4-[4-(4-chlorophenyl)piperazin-1-yl]-3-(phenylsulfonylamino)benzoic acid

Systemtic Name: 4-[4-(4-chlorophenyl)piperazin-1-yl]-3-(phenylsulfonylamino)benzoic acid Openeye Name: 3-(benzenesulfonamido)-4-[4-(4-chlorophenyl)piperazin-1-yl]benzoic acid CAS Name: 3-(benzenesulfonamido)-4-[4-(4-chlorophenyl)-1-piperazinyl]benzoic acid IUPAC Name: 3-(benzenesulfonamido)-4-[4-(4-chlorophenyl)piperazin-1-yl]benzoic acid Traditional Name: 3-(benzenesulfonamido)-4-[4-(4-chlorophenyl)piperazino]benzoic acid Formula: C23H22ClN3O4S MolecularWeight: 471.95648

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)Cl)C3=C(C=C(C=C3)C(=O)O)NS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)Cl)C3=C(C=C(C=C3)C(=O)O)NS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H22ClN3O4S/c24-18-7-9-19(10-8-18)26-12-14-27(15-13-26)22-11-6-17(23(28)29)16-21(22)25-32(30,31)20-4-2-1-3-5-20/h1-11,16,25H,12-15H2,(H,28,29)