4-chloranyl-3-[[2-(piperidin-1-ylmethyl)phenyl]methylsulfamoyl]benzoic acid

Systemtic Name: 4-chloranyl-3-[[2-(piperidin-1-ylmethyl)phenyl]methylsulfamoyl]benzoic acid Openeye Name: 4-chloro-3-[[2-(1-piperidylmethyl)phenyl]methylsulfamoyl]benzoic acid CAS Name: 4-chloro-3-[[2-(1-piperidinylmethyl)phenyl]methylsulfamoyl]benzoic acid IUPAC Name: 4-chloro-3-[[2-(piperidin-1-ylmethyl)phenyl]methylsulfamoyl]benzoic acid Traditional Name: 4-chloro-3-[[2-(piperidinomethyl)benzyl]sulfamoyl]benzoic acid Formula: C20H23ClN2O4S MolecularWeight: 422.92562

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC=CC=C2CNS(=O)(=O)C3=C(C=CC(=C3)C(=O)O)Cl

Isomeric SMILES

C1CCN(CC1)CC2=CC=CC=C2CNS(=O)(=O)C3=C(C=CC(=C3)C(=O)O)Cl

InChI

InChI=1S/C20H23ClN2O4S/c21-18-9-8-15(20(24)25)12-19(18)28(26,27)22-13-16-6-2-3-7-17(16)14-23-10-4-1-5-11-23/h2-3,6-9,12,22H,1,4-5,10-11,13-14H2,(H,24,25)