4-[bis(fluoranyl)methyl]-3-bromanyl-benzoic acid

Systemtic Name: 4-[bis(fluoranyl)methyl]-3-bromanyl-benzoic acid Openeye Name: 3-bromo-4-(difluoromethyl)benzoic acid CAS Name: 3-bromo-4-(difluoromethyl)benzoic acid IUPAC Name: 3-bromo-4-(difluoromethyl)benzoic acid Traditional Name: 3-bromo-4-(difluoromethyl)benzoic acid Formula: C8H5BrF2O2 MolecularWeight: 251.024906

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)O)Br)C(F)F

Isomeric SMILES

C1=CC(=C(C=C1C(=O)O)Br)C(F)F

InChI

InChI=1S/C8H5BrF2O2/c9-6-3-4(8(12)13)1-2-5(6)7(10)11/h1-3,7H,(H,12,13)