2-(4-bromanyl-2-fluoranyl-phenyl)-2-(diethylamino)ethanoic acid

Systemtic Name: 2-(4-bromanyl-2-fluoranyl-phenyl)-2-(diethylamino)ethanoic acid Openeye Name: 2-(4-bromo-2-fluoro-phenyl)-2-(diethylamino)acetic acid CAS Name: 2-(4-bromo-2-fluorophenyl)-2-(diethylamino)acetic acid IUPAC Name: 2-(4-bromo-2-fluorophenyl)-2-(diethylamino)acetic acid Traditional Name: 2-(4-bromo-2-fluoro-phenyl)-2-(diethylamino)acetic acid Formula: C12H15BrFNO2 MolecularWeight: 304.155403

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15BrFNO2/c1-3-15(4-2)11(12(16)17)9-6-5-8(13)7-10(9)14/h5-7,11H,3-4H2,1-2H3,(H,16,17)