(2,5-dimethoxyphenyl)methyl (E)-2-cyano-3-(4-ethoxyphenyl)prop-2-enoate

Systemtic Name: (2,5-dimethoxyphenyl)methyl (E)-2-cyano-3-(4-ethoxyphenyl)prop-2-enoate Openeye Name: (2,5-dimethoxyphenyl)methyl (E)-2-cyano-3-(4-ethoxyphenyl)prop-2-enoate CAS Name: (E)-2-cyano-3-(4-ethoxyphenyl)-2-propenoic acid (2,5-dimethoxyphenyl)methyl ester IUPAC Name: (2,5-dimethoxyphenyl)methyl (E)-2-cyano-3-(4-ethoxyphenyl)prop-2-enoate Traditional Name: (E)-2-cyano-3-p-phenetyl-acrylic acid (2,5-dimethoxybenzyl) ester Formula: C21H21NO5 MolecularWeight: 367.39514

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C=C(C#N)C(=O)OCC2=C(C=CC(=C2)OC)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)/C=C(\C#N)/C(=O)OCC2=C(C=CC(=C2)OC)OC

InChI

InChI=1S/C21H21NO5/c1-4-26-18-7-5-15(6-8-18)11-16(13-22)21(23)27-14-17-12-19(24-2)9-10-20(17)25-3/h5-12H,4,14H2,1-3H3/b16-11+