(4-bromanyl-2-fluoranyl-phenyl)methyl 5-methoxy-2,3-dihydro-1,4-benzodioxine-7-carboxylate

Systemtic Name: (4-bromanyl-2-fluoranyl-phenyl)methyl 5-methoxy-2,3-dihydro-1,4-benzodioxine-7-carboxylate Openeye Name: (4-bromo-2-fluoro-phenyl)methyl 5-methoxy-2,3-dihydro-1,4-benzodioxine-7-carboxylate CAS Name: 5-methoxy-2,3-dihydro-1,4-benzodioxin-7-carboxylic acid (4-bromo-2-fluorophenyl)methyl ester IUPAC Name: (4-bromo-2-fluorophenyl)methyl 5-methoxy-2,3-dihydro-1,4-benzodioxine-7-carboxylate Traditional Name: 5-methoxy-2,3-dihydro-1,4-benzodioxin-7-carboxylic acid (4-bromo-2-fluoro-benzyl) ester Formula: C17H14BrFO5 MolecularWeight: 397.192463

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC2=C1OCCO2)C(=O)OCC3=C(C=C(C=C3)Br)F

Isomeric SMILES

COC1=CC(=CC2=C1OCCO2)C(=O)OCC3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C17H14BrFO5/c1-21-14-6-11(7-15-16(14)23-5-4-22-15)17(20)24-9-10-2-3-12(18)8-13(10)19/h2-3,6-8H,4-5,9H2,1H3