(4-pentylphenyl) (E)-3-(4-cyanophenyl)prop-2-enoate

Systemtic Name: (4-pentylphenyl) (E)-3-(4-cyanophenyl)prop-2-enoate Openeye Name: (4-pentylphenyl) (E)-3-(4-cyanophenyl)prop-2-enoate CAS Name: (E)-3-(4-cyanophenyl)-2-propenoic acid (4-pentylphenyl) ester IUPAC Name: (4-pentylphenyl) (E)-3-(4-cyanophenyl)prop-2-enoate Traditional Name: (E)-3-(4-cyanophenyl)acrylic acid (4-amylphenyl) ester Formula: C21H21NO2 MolecularWeight: 319.39694

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)OC(=O)C=CC2=CC=C(C=C2)C#N

Isomeric SMILES

CCCCCC1=CC=C(C=C1)OC(=O)/C=C/C2=CC=C(C=C2)C#N

InChI

InChI=1S/C21H21NO2/c1-2-3-4-5-17-10-13-20(14-11-17)24-21(23)15-12-18-6-8-19(16-22)9-7-18/h6-15H,2-5H2,1H3/b15-12+