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

Systemtic Name: ethyl (E)-3-[3-[2-(4-bromanyl-2-tert-butyl-phenoxy)ethanoyloxy]phenyl]-2-cyano-prop-2-enoate Openeye Name: ethyl (E)-3-[3-[2-(4-bromo-2-tert-butyl-phenoxy)acetyl]oxyphenyl]-2-cyano-prop-2-enoate CAS Name: (E)-3-[3-[2-(4-bromo-2-tert-butylphenoxy)-1-oxoethoxy]phenyl]-2-cyano-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[3-[2-(4-bromo-2-tert-butylphenoxy)acetyl]oxyphenyl]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[3-[2-(4-bromo-2-tert-butyl-phenoxy)acetyl]oxyphenyl]-2-cyano-acrylic acid ethyl ester Formula: C24H24BrNO5 MolecularWeight: 486.35506

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=CC(=CC=C1)OC(=O)COC2=C(C=C(C=C2)Br)C(C)(C)C)C#N

Isomeric SMILES

CCOC(=O)/C(=C/C1=CC(=CC=C1)OC(=O)COC2=C(C=C(C=C2)Br)C(C)(C)C)/C#N

InChI

InChI=1S/C24H24BrNO5/c1-5-29-23(28)17(14-26)11-16-7-6-8-19(12-16)31-22(27)15-30-21-10-9-18(25)13-20(21)24(2,3)4/h6-13H,5,15H2,1-4H3/b17-11+