3-[(4-piperidin-1-ylcarbonylphenyl)methylsulfamoyl]benzoic acid

Systemtic Name: 3-[(4-piperidin-1-ylcarbonylphenyl)methylsulfamoyl]benzoic acid Openeye Name: 3-[[4-(piperidine-1-carbonyl)phenyl]methylsulfamoyl]benzoic acid CAS Name: 3-[[4-[oxo(1-piperidinyl)methyl]phenyl]methylsulfamoyl]benzoic acid IUPAC Name: 3-[[4-(piperidine-1-carbonyl)phenyl]methylsulfamoyl]benzoic acid Traditional Name: 3-[[4-(piperidine-1-carbonyl)benzyl]sulfamoyl]benzoic acid Formula: C20H22N2O5S MolecularWeight: 402.46408

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=CC=C(C=C2)CNS(=O)(=O)C3=CC=CC(=C3)C(=O)O

Isomeric SMILES

C1CCN(CC1)C(=O)C2=CC=C(C=C2)CNS(=O)(=O)C3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C20H22N2O5S/c23-19(22-11-2-1-3-12-22)16-9-7-15(8-10-16)14-21-28(26,27)18-6-4-5-17(13-18)20(24)25/h4-10,13,21H,1-3,11-12,14H2,(H,24,25)