2-bromanyl-3,4-bis(fluoranyl)-6-[(4-iodanyl-2-methyl-phenyl)amino]benzoic acid

Systemtic Name: 2-bromanyl-3,4-bis(fluoranyl)-6-[(4-iodanyl-2-methyl-phenyl)amino]benzoic acid Openeye Name: 2-bromo-3,4-difluoro-6-(4-iodo-2-methyl-anilino)benzoic acid CAS Name: 2-bromo-3,4-difluoro-6-(4-iodo-2-methylanilino)benzoic acid IUPAC Name: 2-bromo-3,4-difluoro-6-(4-iodo-2-methylanilino)benzoic acid Traditional Name: 2-bromo-3,4-difluoro-6-(4-iodo-2-methyl-anilino)benzoic acid Formula: C14H9BrF2INO2 MolecularWeight: 468.032036

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)I)NC2=CC(=C(C(=C2C(=O)O)Br)F)F

Isomeric SMILES

CC1=C(C=CC(=C1)I)NC2=CC(=C(C(=C2C(=O)O)Br)F)F

InChI

InChI=1S/C14H9BrF2INO2/c1-6-4-7(18)2-3-9(6)19-10-5-8(16)13(17)12(15)11(10)14(20)21/h2-5,19H,1H3,(H,20,21)