(4-bromanyl-2-fluoranyl-phenyl)methyl (3S)-2,3-dihydro-1,4-benzodioxine-3-carboxylate

Systemtic Name: (4-bromanyl-2-fluoranyl-phenyl)methyl (3S)-2,3-dihydro-1,4-benzodioxine-3-carboxylate Openeye Name: (4-bromo-2-fluoro-phenyl)methyl (3S)-2,3-dihydro-1,4-benzodioxine-3-carboxylate CAS Name: (3S)-2,3-dihydro-1,4-benzodioxin-3-carboxylic acid (4-bromo-2-fluorophenyl)methyl ester IUPAC Name: (4-bromo-2-fluorophenyl)methyl (3S)-2,3-dihydro-1,4-benzodioxine-3-carboxylate Traditional Name: (3S)-2,3-dihydro-1,4-benzodioxin-3-carboxylic acid (4-bromo-2-fluoro-benzyl) ester Formula: C16H12BrFO4 MolecularWeight: 367.166483

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2O1)C(=O)OCC3=C(C=C(C=C3)Br)F

Isomeric SMILES

C1[C@H](OC2=CC=CC=C2O1)C(=O)OCC3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C16H12BrFO4/c17-11-6-5-10(12(18)7-11)8-21-16(19)15-9-20-13-3-1-2-4-14(13)22-15/h1-7,15H,8-9H2/t15-/m0/s1