(3,5-dimethylphenyl) (E)-3-(4-butoxyphenyl)-2-cyano-prop-2-enoate

Systemtic Name: (3,5-dimethylphenyl) (E)-3-(4-butoxyphenyl)-2-cyano-prop-2-enoate Openeye Name: (3,5-dimethylphenyl) (E)-3-(4-butoxyphenyl)-2-cyano-prop-2-enoate CAS Name: (E)-3-(4-butoxyphenyl)-2-cyano-2-propenoic acid (3,5-dimethylphenyl) ester IUPAC Name: (3,5-dimethylphenyl) (E)-3-(4-butoxyphenyl)-2-cyanoprop-2-enoate Traditional Name: (E)-3-(4-butoxyphenyl)-2-cyano-acrylic acid (3,5-dimethylphenyl) ester Formula: C22H23NO3 MolecularWeight: 349.42292

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C=C(C#N)C(=O)OC2=CC(=CC(=C2)C)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)/C=C(\C#N)/C(=O)OC2=CC(=CC(=C2)C)C

InChI

InChI=1S/C22H23NO3/c1-4-5-10-25-20-8-6-18(7-9-20)14-19(15-23)22(24)26-21-12-16(2)11-17(3)13-21/h6-9,11-14H,4-5,10H2,1-3H3/b19-14+