methyl 5-[(5-bromanyl-2-iodanyl-phenyl)carbonylamino]-2,4-bis(fluoranyl)benzoate

Systemtic Name: methyl 5-[(5-bromanyl-2-iodanyl-phenyl)carbonylamino]-2,4-bis(fluoranyl)benzoate Openeye Name: methyl 5-[(5-bromo-2-iodo-benzoyl)amino]-2,4-difluoro-benzoate CAS Name: 5-[[(5-bromo-2-iodophenyl)-oxomethyl]amino]-2,4-difluorobenzoic acid methyl ester IUPAC Name: methyl 5-[(5-bromo-2-iodobenzoyl)amino]-2,4-difluorobenzoate Traditional Name: 5-[(5-bromo-2-iodo-benzoyl)amino]-2,4-difluoro-benzoic acid methyl ester Formula: C15H9BrF2INO3 MolecularWeight: 496.042136

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1F)F)NC(=O)C2=C(C=CC(=C2)Br)I

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1F)F)NC(=O)C2=C(C=CC(=C2)Br)I

InChI

InChI=1S/C15H9BrF2INO3/c1-23-15(22)8-5-13(11(18)6-10(8)17)20-14(21)9-4-7(16)2-3-12(9)19/h2-6H,1H3,(H,20,21)