2-ethylhexyl (2E,4E)-2-cyano-5-phenyl-penta-2,4-dienoate

Systemtic Name: 2-ethylhexyl (2E,4E)-2-cyano-5-phenyl-penta-2,4-dienoate Openeye Name: 2-ethylhexyl (2E,4E)-2-cyano-5-phenyl-penta-2,4-dienoate CAS Name: (2E,4E)-2-cyano-5-phenylpenta-2,4-dienoic acid 2-ethylhexyl ester IUPAC Name: 2-ethylhexyl (2E,4E)-2-cyano-5-phenylpenta-2,4-dienoate Traditional Name: (2E,4E)-2-cyano-5-phenyl-penta-2,4-dienoic acid 2-ethylhexyl ester Formula: C20H25NO2 MolecularWeight: 311.418

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC(=O)C(=CC=CC1=CC=CC=C1)C#N

Isomeric SMILES

CCCCC(CC)COC(=O)/C(=C/C=C/C1=CC=CC=C1)/C#N

InChI

InChI=1S/C20H25NO2/c1-3-5-10-17(4-2)16-23-20(22)19(15-21)14-9-13-18-11-7-6-8-12-18/h6-9,11-14,17H,3-5,10,16H2,1-2H3/b13-9+,19-14+