4-methoxy-3-[[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]sulfamoyl]benzoic acid

Systemtic Name: 4-methoxy-3-[[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]sulfamoyl]benzoic acid Openeye Name: 4-methoxy-3-[[2-morpholino-5-(trifluoromethyl)phenyl]sulfamoyl]benzoic acid CAS Name: 4-methoxy-3-[[2-(4-morpholinyl)-5-(trifluoromethyl)phenyl]sulfamoyl]benzoic acid IUPAC Name: 4-methoxy-3-[[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]sulfamoyl]benzoic acid Traditional Name: 4-methoxy-3-[[2-morpholino-5-(trifluoromethyl)phenyl]sulfamoyl]benzoic acid Formula: C19H19F3N2O6S MolecularWeight: 460.42417

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)NC2=C(C=CC(=C2)C(F)(F)F)N3CCOCC3

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)NC2=C(C=CC(=C2)C(F)(F)F)N3CCOCC3

InChI

InChI=1S/C19H19F3N2O6S/c1-29-16-5-2-12(18(25)26)10-17(16)31(27,28)23-14-11-13(19(20,21)22)3-4-15(14)24-6-8-30-9-7-24/h2-5,10-11,23H,6-9H2,1H3,(H,25,26)