(4-bromanyl-2,5-dimethoxy-phenyl)methyl 2,6-bis(fluoranyl)benzoate

Systemtic Name: (4-bromanyl-2,5-dimethoxy-phenyl)methyl 2,6-bis(fluoranyl)benzoate Openeye Name: (4-bromo-2,5-dimethoxy-phenyl)methyl 2,6-difluorobenzoate CAS Name: 2,6-difluorobenzoic acid (4-bromo-2,5-dimethoxyphenyl)methyl ester IUPAC Name: (4-bromo-2,5-dimethoxyphenyl)methyl 2,6-difluorobenzoate Traditional Name: 2,6-difluorobenzoic acid (4-bromo-2,5-dimethoxy-benzyl) ester Formula: C16H13BrF2O4 MolecularWeight: 387.172826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1COC(=O)C2=C(C=CC=C2F)F)OC)Br

Isomeric SMILES

COC1=CC(=C(C=C1COC(=O)C2=C(C=CC=C2F)F)OC)Br

InChI

InChI=1S/C16H13BrF2O4/c1-21-13-7-10(17)14(22-2)6-9(13)8-23-16(20)15-11(18)4-3-5-12(15)19/h3-7H,8H2,1-2H3