ethyl (E)-3-[3-bromanyl-4-[2-(4-cyclohexylphenoxy)ethoxy]-5-methoxy-phenyl]-2-cyano-prop-2-enoate

Systemtic Name: ethyl (E)-3-[3-bromanyl-4-[2-(4-cyclohexylphenoxy)ethoxy]-5-methoxy-phenyl]-2-cyano-prop-2-enoate Openeye Name: ethyl (E)-3-[3-bromo-4-[2-(4-cyclohexylphenoxy)ethoxy]-5-methoxy-phenyl]-2-cyano-prop-2-enoate CAS Name: (E)-3-[3-bromo-4-[2-(4-cyclohexylphenoxy)ethoxy]-5-methoxyphenyl]-2-cyano-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[3-bromo-4-[2-(4-cyclohexylphenoxy)ethoxy]-5-methoxyphenyl]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[3-bromo-4-[2-(4-cyclohexylphenoxy)ethoxy]-5-methoxy-phenyl]-2-cyano-acrylic acid ethyl ester Formula: C27H30BrNO5 MolecularWeight: 528.4348

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=CC(=C(C(=C1)Br)OCCOC2=CC=C(C=C2)C3CCCCC3)OC)C#N

Isomeric SMILES

CCOC(=O)/C(=C/C1=CC(=C(C(=C1)Br)OCCOC2=CC=C(C=C2)C3CCCCC3)OC)/C#N

InChI

InChI=1S/C27H30BrNO5/c1-3-32-27(30)22(18-29)15-19-16-24(28)26(25(17-19)31-2)34-14-13-33-23-11-9-21(10-12-23)20-7-5-4-6-8-20/h9-12,15-17,20H,3-8,13-14H2,1-2H3/b22-15+