(5-ethanoyl-2-ethoxy-phenyl)methyl (E)-3-[4-(cyanomethoxy)-3-methoxy-phenyl]prop-2-enoate

Systemtic Name: (5-ethanoyl-2-ethoxy-phenyl)methyl (E)-3-[4-(cyanomethoxy)-3-methoxy-phenyl]prop-2-enoate Openeye Name: (5-acetyl-2-ethoxy-phenyl)methyl (E)-3-[4-(cyanomethoxy)-3-methoxy-phenyl]prop-2-enoate CAS Name: (E)-3-[4-(cyanomethoxy)-3-methoxyphenyl]-2-propenoic acid (5-acetyl-2-ethoxyphenyl)methyl ester IUPAC Name: (5-acetyl-2-ethoxyphenyl)methyl (E)-3-[4-(cyanomethoxy)-3-methoxyphenyl]prop-2-enoate Traditional Name: (E)-3-[4-(cyanomethoxy)-3-methoxy-phenyl]acrylic acid (5-acetyl-2-ethoxy-benzyl) ester Formula: C23H23NO6 MolecularWeight: 409.43182

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)C)COC(=O)C=CC2=CC(=C(C=C2)OCC#N)OC

Isomeric SMILES

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

InChI

InChI=1S/C23H23NO6/c1-4-28-20-9-7-18(16(2)25)14-19(20)15-30-23(26)10-6-17-5-8-21(29-12-11-24)22(13-17)27-3/h5-10,13-14H,4,12,15H2,1-3H3/b10-6+