2-[[2,6-bis(bromanyl)-4-methyl-phenyl]amino]ethanoate

Systemtic Name: 2-[[2,6-bis(bromanyl)-4-methyl-phenyl]amino]ethanoate Openeye Name: 2-(2,6-dibromo-4-methyl-anilino)acetate CAS Name: 2-(2,6-dibromo-4-methylanilino)acetate IUPAC Name: 2-(2,6-dibromo-4-methylanilino)acetate Traditional Name: 2-(2,6-dibromo-4-methyl-anilino)acetate Formula: C9H8Br2NO2- MolecularWeight: 321.97332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Br)NCC(=O)[O-])Br

Isomeric SMILES

CC1=CC(=C(C(=C1)Br)NCC(=O)[O-])Br

InChI

InChI=1S/C9H9Br2NO2/c1-5-2-6(10)9(7(11)3-5)12-4-8(13)14/h2-3,12H,4H2,1H3,(H,13,14)/p-1