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

Systemtic Name: ethyl (E)-3-[3-[4-(2-bromanyl-4-ethyl-phenoxy)butanoyloxy]phenyl]-2-cyano-prop-2-enoate Openeye Name: ethyl (E)-3-[3-[4-(2-bromo-4-ethyl-phenoxy)butanoyloxy]phenyl]-2-cyano-prop-2-enoate CAS Name: (E)-3-[3-[4-(2-bromo-4-ethylphenoxy)-1-oxobutoxy]phenyl]-2-cyano-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[3-[4-(2-bromo-4-ethylphenoxy)butanoyloxy]phenyl]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[3-[4-(2-bromo-4-ethyl-phenoxy)butanoyloxy]phenyl]-2-cyano-acrylic acid ethyl ester Formula: C24H24BrNO5 MolecularWeight: 486.35506

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H24BrNO5/c1-3-17-10-11-22(21(25)15-17)30-12-6-9-23(27)31-20-8-5-7-18(14-20)13-19(16-26)24(28)29-4-2/h5,7-8,10-11,13-15H,3-4,6,9,12H2,1-2H3/b19-13+