ethyl (E)-2-cyano-3-[4-[2-(4-hexoxyphenoxy)ethoxy]phenyl]prop-2-enoate

Systemtic Name: ethyl (E)-2-cyano-3-[4-[2-(4-hexoxyphenoxy)ethoxy]phenyl]prop-2-enoate Openeye Name: ethyl (E)-2-cyano-3-[4-[2-(4-hexoxyphenoxy)ethoxy]phenyl]prop-2-enoate CAS Name: (E)-2-cyano-3-[4-[2-(4-hexoxyphenoxy)ethoxy]phenyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-2-cyano-3-[4-[2-(4-hexoxyphenoxy)ethoxy]phenyl]prop-2-enoate Traditional Name: (E)-2-cyano-3-[4-[2-(4-hexoxyphenoxy)ethoxy]phenyl]acrylic acid ethyl ester Formula: C26H31NO5 MolecularWeight: 437.52804

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)OCCOC2=CC=C(C=C2)C=C(C#N)C(=O)OCC

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)OCCOC2=CC=C(C=C2)/C=C(\C#N)/C(=O)OCC

InChI

InChI=1S/C26H31NO5/c1-3-5-6-7-16-30-24-12-14-25(15-13-24)32-18-17-31-23-10-8-21(9-11-23)19-22(20-27)26(28)29-4-2/h8-15,19H,3-7,16-18H2,1-2H3/b22-19+