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

Systemtic Name: (3,5-dimethylphenyl) 2-cyano-3-(4-propoxyphenyl)prop-2-enoate Openeye Name: (3,5-dimethylphenyl) 2-cyano-3-(4-propoxyphenyl)prop-2-enoate CAS Name: 2-cyano-3-(4-propoxyphenyl)-2-propenoic acid (3,5-dimethylphenyl) ester IUPAC Name: (3,5-dimethylphenyl) 2-cyano-3-(4-propoxyphenyl)prop-2-enoate Traditional Name: 2-cyano-3-(4-propoxyphenyl)acrylic acid (3,5-dimethylphenyl) ester Formula: C21H21NO3 MolecularWeight: 335.39634

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C=C(C#N)C(=O)OC2=CC(=CC(=C2)C)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)C=C(C#N)C(=O)OC2=CC(=CC(=C2)C)C

InChI

InChI=1S/C21H21NO3/c1-4-9-24-19-7-5-17(6-8-19)13-18(14-22)21(23)25-20-11-15(2)10-16(3)12-20/h5-8,10-13H,4,9H2,1-3H3