3-[4-[[4-acetamido-2-(trifluoromethyl)phenyl]sulfamoyl]phenyl]propanoic acid

Systemtic Name: 3-[4-[[4-acetamido-2-(trifluoromethyl)phenyl]sulfamoyl]phenyl]propanoic acid Openeye Name: 3-[4-[[4-acetamido-2-(trifluoromethyl)phenyl]sulfamoyl]phenyl]propanoic acid CAS Name: 3-[4-[[4-acetamido-2-(trifluoromethyl)phenyl]sulfamoyl]phenyl]propanoic acid IUPAC Name: 3-[4-[[4-acetamido-2-(trifluoromethyl)phenyl]sulfamoyl]phenyl]propanoic acid Traditional Name: 3-[4-[[4-acetamido-2-(trifluoromethyl)phenyl]sulfamoyl]phenyl]propionic acid Formula: C18H17F3N2O5S MolecularWeight: 430.39819

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)CCC(=O)O)C(F)(F)F

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)CCC(=O)O)C(F)(F)F

InChI

InChI=1S/C18H17F3N2O5S/c1-11(24)22-13-5-8-16(15(10-13)18(19,20)21)23-29(27,28)14-6-2-12(3-7-14)4-9-17(25)26/h2-3,5-8,10,23H,4,9H2,1H3,(H,22,24)(H,25,26)