2-[4-(4-chlorophenyl)piperazin-1-yl]sulfonylbenzoic acid

Systemtic Name: 2-[4-(4-chlorophenyl)piperazin-1-yl]sulfonylbenzoic acid Openeye Name: 2-[4-(4-chlorophenyl)piperazin-1-yl]sulfonylbenzoic acid CAS Name: 2-[[4-(4-chlorophenyl)-1-piperazinyl]sulfonyl]benzoic acid IUPAC Name: 2-[4-(4-chlorophenyl)piperazin-1-yl]sulfonylbenzoic acid Traditional Name: 2-[4-(4-chlorophenyl)piperazino]sulfonylbenzoic acid Formula: C17H17ClN2O4S MolecularWeight: 380.84588

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)Cl)S(=O)(=O)C3=CC=CC=C3C(=O)O

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)Cl)S(=O)(=O)C3=CC=CC=C3C(=O)O

InChI

InChI=1S/C17H17ClN2O4S/c18-13-5-7-14(8-6-13)19-9-11-20(12-10-19)25(23,24)16-4-2-1-3-15(16)17(21)22/h1-8H,9-12H2,(H,21,22)