(2-bromanyl-4-cyano-6-ethoxy-phenyl) 3,5-bis(fluoranyl)benzoate

Systemtic Name: (2-bromanyl-4-cyano-6-ethoxy-phenyl) 3,5-bis(fluoranyl)benzoate Openeye Name: (2-bromo-4-cyano-6-ethoxy-phenyl) 3,5-difluorobenzoate CAS Name: 3,5-difluorobenzoic acid (2-bromo-4-cyano-6-ethoxyphenyl) ester IUPAC Name: (2-bromo-4-cyano-6-ethoxyphenyl) 3,5-difluorobenzoate Traditional Name: 3,5-difluorobenzoic acid (2-bromo-4-cyano-6-ethoxy-phenyl) ester Formula: C16H10BrF2NO3 MolecularWeight: 382.156306

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H10BrF2NO3/c1-2-22-14-4-9(8-20)3-13(17)15(14)23-16(21)10-5-11(18)7-12(19)6-10/h3-7H,2H2,1H3