5-[1-(3-bromophenyl)propyl-ethyl-sulfamoyl]-2,4-bis(fluoranyl)benzoic acid

Systemtic Name: 5-[1-(3-bromophenyl)propyl-ethyl-sulfamoyl]-2,4-bis(fluoranyl)benzoic acid Openeye Name: 5-[1-(3-bromophenyl)propyl-ethyl-sulfamoyl]-2,4-difluoro-benzoic acid CAS Name: 5-[1-(3-bromophenyl)propyl-ethylsulfamoyl]-2,4-difluorobenzoic acid IUPAC Name: 5-[1-(3-bromophenyl)propyl-ethylsulfamoyl]-2,4-difluorobenzoic acid Traditional Name: 5-[1-(3-bromophenyl)propyl-ethyl-sulfamoyl]-2,4-difluoro-benzoic acid Formula: C18H18BrF2NO4S MolecularWeight: 462.305626

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC(=CC=C1)Br)N(CC)S(=O)(=O)C2=C(C=C(C(=C2)C(=O)O)F)F

Isomeric SMILES

CCC(C1=CC(=CC=C1)Br)N(CC)S(=O)(=O)C2=C(C=C(C(=C2)C(=O)O)F)F

InChI

InChI=1S/C18H18BrF2NO4S/c1-3-16(11-6-5-7-12(19)8-11)22(4-2)27(25,26)17-9-13(18(23)24)14(20)10-15(17)21/h5-10,16H,3-4H2,1-2H3,(H,23,24)