2-chloranyl-5-[(3-piperidin-1-ylsulfonylphenyl)sulfamoyl]benzoic acid

Systemtic Name: 2-chloranyl-5-[(3-piperidin-1-ylsulfonylphenyl)sulfamoyl]benzoic acid Openeye Name: 2-chloro-5-[[3-(1-piperidylsulfonyl)phenyl]sulfamoyl]benzoic acid CAS Name: 2-chloro-5-[[3-(1-piperidinylsulfonyl)phenyl]sulfamoyl]benzoic acid IUPAC Name: 2-chloro-5-[(3-piperidin-1-ylsulfonylphenyl)sulfamoyl]benzoic acid Traditional Name: 2-chloro-5-[(3-piperidinosulfonylphenyl)sulfamoyl]benzoic acid Formula: C18H19ClN2O6S2 MolecularWeight: 458.93626

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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