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

Systemtic Name: 4-methoxy-3-[[2-propoxy-5-(trifluoromethyl)phenyl]sulfamoyl]benzoic acid Openeye Name: 4-methoxy-3-[[2-propoxy-5-(trifluoromethyl)phenyl]sulfamoyl]benzoic acid CAS Name: 4-methoxy-3-[[2-propoxy-5-(trifluoromethyl)phenyl]sulfamoyl]benzoic acid IUPAC Name: 4-methoxy-3-[[2-propoxy-5-(trifluoromethyl)phenyl]sulfamoyl]benzoic acid Traditional Name: 4-methoxy-3-[[2-propoxy-5-(trifluoromethyl)phenyl]sulfamoyl]benzoic acid Formula: C18H18F3NO6S MolecularWeight: 433.39883

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(F)(F)F)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)O)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(F)(F)F)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)O)OC

InChI

InChI=1S/C18H18F3NO6S/c1-3-8-28-14-7-5-12(18(19,20)21)10-13(14)22-29(25,26)16-9-11(17(23)24)4-6-15(16)27-2/h4-7,9-10,22H,3,8H2,1-2H3,(H,23,24)