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

Systemtic Name: ethyl (E)-3-[3-[2-(2-bromanyl-4-phenyl-phenoxy)ethanoyloxy]phenyl]-2-cyano-prop-2-enoate Openeye Name: ethyl (E)-3-[3-[2-(2-bromo-4-phenyl-phenoxy)acetyl]oxyphenyl]-2-cyano-prop-2-enoate CAS Name: (E)-3-[3-[2-(2-bromo-4-phenylphenoxy)-1-oxoethoxy]phenyl]-2-cyano-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[3-[2-(2-bromo-4-phenylphenoxy)acetyl]oxyphenyl]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[3-[2-(2-bromo-4-phenyl-phenoxy)acetyl]oxyphenyl]-2-cyano-acrylic acid ethyl ester Formula: C26H20BrNO5 MolecularWeight: 506.3447

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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)C3=CC=CC=C3)Br)C#N

Isomeric SMILES

CCOC(=O)/C(=C/C1=CC(=CC=C1)OC(=O)COC2=C(C=C(C=C2)C3=CC=CC=C3)Br)/C#N

InChI

InChI=1S/C26H20BrNO5/c1-2-31-26(30)21(16-28)13-18-7-6-10-22(14-18)33-25(29)17-32-24-12-11-20(15-23(24)27)19-8-4-3-5-9-19/h3-15H,2,17H2,1H3/b21-13+