4-[(3-bromanyl-4-fluoranyl-phenyl)methylamino]benzoic acid

Systemtic Name: 4-[(3-bromanyl-4-fluoranyl-phenyl)methylamino]benzoic acid Openeye Name: 4-[(3-bromo-4-fluoro-phenyl)methylamino]benzoic acid CAS Name: 4-[(3-bromo-4-fluorophenyl)methylamino]benzoic acid IUPAC Name: 4-[(3-bromo-4-fluorophenyl)methylamino]benzoic acid Traditional Name: 4-[(3-bromo-4-fluoro-benzyl)amino]benzoic acid Formula: C14H11BrFNO2 MolecularWeight: 324.145043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)NCC2=CC(=C(C=C2)F)Br

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)NCC2=CC(=C(C=C2)F)Br

InChI

InChI=1S/C14H11BrFNO2/c15-12-7-9(1-6-13(12)16)8-17-11-4-2-10(3-5-11)14(18)19/h1-7,17H,8H2,(H,18,19)