3-[[4-acetamido-2-(trifluoromethyl)phenyl]sulfamoyl]-4,5-dimethyl-benzoate

Systemtic Name: 3-[[4-acetamido-2-(trifluoromethyl)phenyl]sulfamoyl]-4,5-dimethyl-benzoate Openeye Name: 3-[[4-acetamido-2-(trifluoromethyl)phenyl]sulfamoyl]-4,5-dimethyl-benzoate CAS Name: 3-[[4-acetamido-2-(trifluoromethyl)phenyl]sulfamoyl]-4,5-dimethylbenzoate IUPAC Name: 3-[[4-acetamido-2-(trifluoromethyl)phenyl]sulfamoyl]-4,5-dimethylbenzoate Traditional Name: 3-[[4-acetamido-2-(trifluoromethyl)phenyl]sulfamoyl]-4,5-dimethyl-benzoate Formula: C18H16F3N2O5S- MolecularWeight: 429.39025

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C(=O)[O-])S(=O)(=O)NC2=C(C=C(C=C2)NC(=O)C)C(F)(F)F)C

Isomeric SMILES

CC1=C(C(=CC(=C1)C(=O)[O-])S(=O)(=O)NC2=C(C=C(C=C2)NC(=O)C)C(F)(F)F)C

InChI

InChI=1S/C18H17F3N2O5S/c1-9-6-12(17(25)26)7-16(10(9)2)29(27,28)23-15-5-4-13(22-11(3)24)8-14(15)18(19,20)21/h4-8,23H,1-3H3,(H,22,24)(H,25,26)/p-1