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

Systemtic Name: 2-[(2-chloranyl-4-iodanyl-phenyl)amino]-3,4-bis(fluoranyl)benzenesulfonic acid Openeye Name: 2-(2-chloro-4-iodo-anilino)-3,4-difluoro-benzenesulfonic acid CAS Name: 2-(2-chloro-4-iodoanilino)-3,4-difluorobenzenesulfonic acid IUPAC Name: 2-(2-chloro-4-iodoanilino)-3,4-difluorobenzenesulfonic acid Traditional Name: 2-(2-chloro-4-iodo-anilino)-3,4-difluoro-besylic acid Formula: C12H7ClF2INO3S MolecularWeight: 445.608156

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1I)Cl)NC2=C(C=CC(=C2F)F)S(=O)(=O)O

Isomeric SMILES

C1=CC(=C(C=C1I)Cl)NC2=C(C=CC(=C2F)F)S(=O)(=O)O

InChI

InChI=1S/C12H7ClF2INO3S/c13-7-5-6(16)1-3-9(7)17-12-10(21(18,19)20)4-2-8(14)11(12)15/h1-5,17H,(H,18,19,20)