ethyl (E)-3-[4-[4-(4-tert-butylphenoxy)butanoyloxy]-3-ethoxy-phenyl]-2-cyano-prop-2-enoate

Systemtic Name: ethyl (E)-3-[4-[4-(4-tert-butylphenoxy)butanoyloxy]-3-ethoxy-phenyl]-2-cyano-prop-2-enoate Openeye Name: ethyl (E)-3-[4-[4-(4-tert-butylphenoxy)butanoyloxy]-3-ethoxy-phenyl]-2-cyano-prop-2-enoate CAS Name: (E)-3-[4-[4-(4-tert-butylphenoxy)-1-oxobutoxy]-3-ethoxyphenyl]-2-cyano-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[4-[4-(4-tert-butylphenoxy)butanoyloxy]-3-ethoxyphenyl]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[4-[4-(4-tert-butylphenoxy)butanoyloxy]-3-ethoxy-phenyl]-2-cyano-acrylic acid ethyl ester Formula: C28H33NO6 MolecularWeight: 479.56472

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C(C#N)C(=O)OCC)OC(=O)CCCOC2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C(\C#N)/C(=O)OCC)OC(=O)CCCOC2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C28H33NO6/c1-6-32-25-18-20(17-21(19-29)27(31)33-7-2)10-15-24(25)35-26(30)9-8-16-34-23-13-11-22(12-14-23)28(3,4)5/h10-15,17-18H,6-9,16H2,1-5H3/b21-17+