5-[(4-bromanyl-2-fluoranyl-phenyl)methylamino]-2-fluoranyl-benzoic acid

Systemtic Name: 5-[(4-bromanyl-2-fluoranyl-phenyl)methylamino]-2-fluoranyl-benzoic acid Openeye Name: 5-[(4-bromo-2-fluoro-phenyl)methylamino]-2-fluoro-benzoic acid CAS Name: 5-[(4-bromo-2-fluorophenyl)methylamino]-2-fluorobenzoic acid IUPAC Name: 5-[(4-bromo-2-fluorophenyl)methylamino]-2-fluorobenzoic acid Traditional Name: 5-[(4-bromo-2-fluoro-benzyl)amino]-2-fluoro-benzoic acid Formula: C14H10BrF2NO2 MolecularWeight: 342.135506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NCC2=C(C=C(C=C2)Br)F)C(=O)O)F

Isomeric SMILES

C1=CC(=C(C=C1NCC2=C(C=C(C=C2)Br)F)C(=O)O)F

InChI

InChI=1S/C14H10BrF2NO2/c15-9-2-1-8(13(17)5-9)7-18-10-3-4-12(16)11(6-10)14(19)20/h1-6,18H,7H2,(H,19,20)