4-[[1-(4-chlorophenyl)sulfonylpiperidin-4-yl]carbonylamino]benzoic acid

Systemtic Name: 4-[[1-(4-chlorophenyl)sulfonylpiperidin-4-yl]carbonylamino]benzoic acid Openeye Name: 4-[[1-(4-chlorophenyl)sulfonylpiperidine-4-carbonyl]amino]benzoic acid CAS Name: 4-[[[1-(4-chlorophenyl)sulfonyl-4-piperidinyl]-oxomethyl]amino]benzoic acid IUPAC Name: 4-[[1-(4-chlorophenyl)sulfonylpiperidine-4-carbonyl]amino]benzoic acid Traditional Name: 4-[[1-(4-chlorophenyl)sulfonylisonipecotoyl]amino]benzoic acid Formula: C19H19ClN2O5S MolecularWeight: 422.88256

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=C(C=C2)C(=O)O)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=C(C=C2)C(=O)O)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H19ClN2O5S/c20-15-3-7-17(8-4-15)28(26,27)22-11-9-13(10-12-22)18(23)21-16-5-1-14(2-6-16)19(24)25/h1-8,13H,9-12H2,(H,21,23)(H,24,25)