5-[1-(3-bromophenyl)ethylamino]-2-fluoranyl-benzoic acid

Systemtic Name: 5-[1-(3-bromophenyl)ethylamino]-2-fluoranyl-benzoic acid Openeye Name: 5-[1-(3-bromophenyl)ethylamino]-2-fluoro-benzoic acid CAS Name: 5-[1-(3-bromophenyl)ethylamino]-2-fluorobenzoic acid IUPAC Name: 5-[1-(3-bromophenyl)ethylamino]-2-fluorobenzoic acid Traditional Name: 5-[1-(3-bromophenyl)ethylamino]-2-fluoro-benzoic acid Formula: C15H13BrFNO2 MolecularWeight: 338.171623

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)Br)NC2=CC(=C(C=C2)F)C(=O)O

Isomeric SMILES

CC(C1=CC(=CC=C1)Br)NC2=CC(=C(C=C2)F)C(=O)O

InChI

InChI=1S/C15H13BrFNO2/c1-9(10-3-2-4-11(16)7-10)18-12-5-6-14(17)13(8-12)15(19)20/h2-9,18H,1H3,(H,19,20)