2-[(2-methoxy-2-oxidanylidene-ethyl)-[2-(trifluoromethyl)phenyl]sulfamoyl]benzoic acid

Systemtic Name: 2-[(2-methoxy-2-oxidanylidene-ethyl)-[2-(trifluoromethyl)phenyl]sulfamoyl]benzoic acid Openeye Name: 2-[(2-methoxy-2-oxo-ethyl)-[2-(trifluoromethyl)phenyl]sulfamoyl]benzoic acid CAS Name: 2-[(2-methoxy-2-oxoethyl)-[2-(trifluoromethyl)phenyl]sulfamoyl]benzoic acid IUPAC Name: 2-[(2-methoxy-2-oxoethyl)-[2-(trifluoromethyl)phenyl]sulfamoyl]benzoic acid Traditional Name: 2-[(2-keto-2-methoxy-ethyl)-[2-(trifluoromethyl)phenyl]sulfamoyl]benzoic acid Formula: C17H14F3NO6S MolecularWeight: 417.35637

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN(C1=CC=CC=C1C(F)(F)F)S(=O)(=O)C2=CC=CC=C2C(=O)O

Isomeric SMILES

COC(=O)CN(C1=CC=CC=C1C(F)(F)F)S(=O)(=O)C2=CC=CC=C2C(=O)O

InChI

InChI=1S/C17H14F3NO6S/c1-27-15(22)10-21(13-8-4-3-7-12(13)17(18,19)20)28(25,26)14-9-5-2-6-11(14)16(23)24/h2-9H,10H2,1H3,(H,23,24)