4-[(4-chloranyl-3-piperidin-1-ylsulfonyl-phenyl)sulfamoyl]benzoic acid

Systemtic Name: 4-[(4-chloranyl-3-piperidin-1-ylsulfonyl-phenyl)sulfamoyl]benzoic acid Openeye Name: 4-[[4-chloro-3-(1-piperidylsulfonyl)phenyl]sulfamoyl]benzoic acid CAS Name: 4-[[4-chloro-3-(1-piperidinylsulfonyl)phenyl]sulfamoyl]benzoic acid IUPAC Name: 4-[(4-chloro-3-piperidin-1-ylsulfonylphenyl)sulfamoyl]benzoic acid Traditional Name: 4-[(4-chloro-3-piperidinosulfonyl-phenyl)sulfamoyl]benzoic acid Formula: C18H19ClN2O6S2 MolecularWeight: 458.93626

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)NS(=O)(=O)C3=CC=C(C=C3)C(=O)O)Cl

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)NS(=O)(=O)C3=CC=C(C=C3)C(=O)O)Cl

InChI

InChI=1S/C18H19ClN2O6S2/c19-16-9-6-14(12-17(16)29(26,27)21-10-2-1-3-11-21)20-28(24,25)15-7-4-13(5-8-15)18(22)23/h4-9,12,20H,1-3,10-11H2,(H,22,23)