2-[2-bromanyl-4-[(E)-2-cyano-2-(3-fluorophenyl)ethenyl]-6-methoxy-phenoxy]ethanoate

Systemtic Name: 2-[2-bromanyl-4-[(E)-2-cyano-2-(3-fluorophenyl)ethenyl]-6-methoxy-phenoxy]ethanoate Openeye Name: 2-[2-bromo-4-[(E)-2-cyano-2-(3-fluorophenyl)vinyl]-6-methoxy-phenoxy]acetate CAS Name: 2-[2-bromo-4-[(E)-2-cyano-2-(3-fluorophenyl)ethenyl]-6-methoxyphenoxy]acetate IUPAC Name: 2-[2-bromo-4-[(E)-2-cyano-2-(3-fluorophenyl)ethenyl]-6-methoxyphenoxy]acetate Traditional Name: 2-[2-bromo-4-[(E)-2-cyano-2-(3-fluorophenyl)vinyl]-6-methoxy-phenoxy]acetate Formula: C18H12BrFNO4- MolecularWeight: 405.194583

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=C(C#N)C2=CC(=CC=C2)F)Br)OCC(=O)[O-]

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=C(/C#N)\C2=CC(=CC=C2)F)Br)OCC(=O)[O-]

InChI

InChI=1S/C18H13BrFNO4/c1-24-16-7-11(6-15(19)18(16)25-10-17(22)23)5-13(9-21)12-3-2-4-14(20)8-12/h2-8H,10H2,1H3,(H,22,23)/p-1/b13-5-