ethyl (E)-3-[3-[2-(4-bromanyl-2-ethyl-phenoxy)ethanoyloxy]phenyl]-2-cyano-prop-2-enoate

Systemtic Name: ethyl (E)-3-[3-[2-(4-bromanyl-2-ethyl-phenoxy)ethanoyloxy]phenyl]-2-cyano-prop-2-enoate Openeye Name: ethyl (E)-3-[3-[2-(4-bromo-2-ethyl-phenoxy)acetyl]oxyphenyl]-2-cyano-prop-2-enoate CAS Name: (E)-3-[3-[2-(4-bromo-2-ethylphenoxy)-1-oxoethoxy]phenyl]-2-cyano-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[3-[2-(4-bromo-2-ethylphenoxy)acetyl]oxyphenyl]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[3-[2-(4-bromo-2-ethyl-phenoxy)acetyl]oxyphenyl]-2-cyano-acrylic acid ethyl ester Formula: C22H20BrNO5 MolecularWeight: 458.3019

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)Br)OCC(=O)OC2=CC=CC(=C2)C=C(C#N)C(=O)OCC

Isomeric SMILES

CCC1=C(C=CC(=C1)Br)OCC(=O)OC2=CC=CC(=C2)/C=C(\C#N)/C(=O)OCC

InChI

InChI=1S/C22H20BrNO5/c1-3-16-12-18(23)8-9-20(16)28-14-21(25)29-19-7-5-6-15(11-19)10-17(13-24)22(26)27-4-2/h5-12H,3-4,14H2,1-2H3/b17-10+