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

Systemtic Name: 5-bromanyl-2-[(2-chloranyl-4-iodanyl-phenyl)amino]-3,4-bis(fluoranyl)benzoic acid Openeye Name: 5-bromo-2-(2-chloro-4-iodo-anilino)-3,4-difluoro-benzoic acid CAS Name: 5-bromo-2-(2-chloro-4-iodoanilino)-3,4-difluorobenzoic acid IUPAC Name: 5-bromo-2-(2-chloro-4-iodoanilino)-3,4-difluorobenzoic acid Traditional Name: 5-bromo-2-(2-chloro-4-iodo-anilino)-3,4-difluoro-benzoic acid Formula: C13H6BrClF2INO2 MolecularWeight: 488.450516

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1I)Cl)NC2=C(C(=C(C=C2C(=O)O)Br)F)F

Isomeric SMILES

C1=CC(=C(C=C1I)Cl)NC2=C(C(=C(C=C2C(=O)O)Br)F)F

InChI

InChI=1S/C13H6BrClF2INO2/c14-7-4-6(13(20)21)12(11(17)10(7)16)19-9-2-1-5(18)3-8(9)15/h1-4,19H,(H,20,21)