[(2R)-1-methoxypropan-2-yl] (E)-3-(5-bromanyl-2-fluoranyl-phenyl)-2-cyano-prop-2-enoate

Systemtic Name: [(2R)-1-methoxypropan-2-yl] (E)-3-(5-bromanyl-2-fluoranyl-phenyl)-2-cyano-prop-2-enoate Openeye Name: [(1R)-2-methoxy-1-methyl-ethyl] (E)-3-(5-bromo-2-fluoro-phenyl)-2-cyano-prop-2-enoate CAS Name: (E)-3-(5-bromo-2-fluorophenyl)-2-cyano-2-propenoic acid [(2R)-1-methoxypropan-2-yl] ester IUPAC Name: [(2R)-1-methoxypropan-2-yl] (E)-3-(5-bromo-2-fluorophenyl)-2-cyanoprop-2-enoate Traditional Name: (E)-3-(5-bromo-2-fluoro-phenyl)-2-cyano-acrylic acid [(1R)-2-methoxy-1-methyl-ethyl] ester Formula: C14H13BrFNO3 MolecularWeight: 342.160323

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC)OC(=O)C(=CC1=C(C=CC(=C1)Br)F)C#N

Isomeric SMILES

C[C@H](COC)OC(=O)/C(=C/C1=C(C=CC(=C1)Br)F)/C#N

InChI

InChI=1S/C14H13BrFNO3/c1-9(8-19-2)20-14(18)11(7-17)5-10-6-12(15)3-4-13(10)16/h3-6,9H,8H2,1-2H3/b11-5+/t9-/m1/s1