(2-bromanyl-4-cyano-6-ethoxy-phenyl) 3,4-bis(fluoranyl)benzenesulfonate

Systemtic Name: (2-bromanyl-4-cyano-6-ethoxy-phenyl) 3,4-bis(fluoranyl)benzenesulfonate Openeye Name: (2-bromo-4-cyano-6-ethoxy-phenyl) 3,4-difluorobenzenesulfonate CAS Name: 3,4-difluorobenzenesulfonic acid (2-bromo-4-cyano-6-ethoxyphenyl) ester IUPAC Name: (2-bromo-4-cyano-6-ethoxyphenyl) 3,4-difluorobenzenesulfonate Traditional Name: 3,4-difluorobenzenesulfonic acid (2-bromo-4-cyano-6-ethoxy-phenyl) ester Formula: C15H10BrF2NO4S MolecularWeight: 418.210006

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C#N)Br)OS(=O)(=O)C2=CC(=C(C=C2)F)F

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C#N)Br)OS(=O)(=O)C2=CC(=C(C=C2)F)F

InChI

InChI=1S/C15H10BrF2NO4S/c1-2-22-14-6-9(8-19)5-11(16)15(14)23-24(20,21)10-3-4-12(17)13(18)7-10/h3-7H,2H2,1H3