(2-bromanyl-4,5-dimethoxy-phenyl)methyl 3-fluoranylbenzoate

Systemtic Name: (2-bromanyl-4,5-dimethoxy-phenyl)methyl 3-fluoranylbenzoate Openeye Name: (2-bromo-4,5-dimethoxy-phenyl)methyl 3-fluorobenzoate CAS Name: 3-fluorobenzoic acid (2-bromo-4,5-dimethoxyphenyl)methyl ester IUPAC Name: (2-bromo-4,5-dimethoxyphenyl)methyl 3-fluorobenzoate Traditional Name: 3-fluorobenzoic acid (2-bromo-4,5-dimethoxy-benzyl) ester Formula: C16H14BrFO4 MolecularWeight: 369.182363

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)COC(=O)C2=CC(=CC=C2)F)Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)COC(=O)C2=CC(=CC=C2)F)Br)OC

InChI

InChI=1S/C16H14BrFO4/c1-20-14-7-11(13(17)8-15(14)21-2)9-22-16(19)10-4-3-5-12(18)6-10/h3-8H,9H2,1-2H3