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3-piperidin-1-yl-5-sulfamoyl-4-(trifluoromethyl)benzoic acid

3-piperidin-1-yl-5-sulfamoyl-4-(trifluoromethyl)benzoic acid

Systemtic Name:3-piperidin-1-yl-5-sulfamoyl-4-(trifluoromethyl)benzoic acid
Openeye Name:3-(1-piperidyl)-5-sulfamoyl-4-(trifluoromethyl)benzoic acid
CAS Name:3-(1-piperidinyl)-5-sulfamoyl-4-(trifluoromethyl)benzoic acid
IUPAC Name:3-piperidin-1-yl-5-sulfamoyl-4-(trifluoromethyl)benzoic acid
Traditional Name:3-piperidino-5-sulfamoyl-4-(trifluoromethyl)benzoic acid
Formula: C13H15F3N2O4S
MolecularWeight: 352.32941
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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C(=CC(=C2)C(=O)O)S(=O)(=O)N)C(F)(F)F


Isomeric SMILES

C1CCN(CC1)C2=C(C(=CC(=C2)C(=O)O)S(=O)(=O)N)C(F)(F)F


InChI

InChI=1S/C13H15F3N2O4S/c14-13(15,16)11-9(18-4-2-1-3-5-18)6-8(12(19)20)7-10(11)23(17,21)22/h6-7H,1-5H2,(H,19,20)(H2,17,21,22)


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