3-methylbutyl (2Z,4E)-2-cyano-5-phenyl-penta-2,4-dienoate

Systemtic Name: 3-methylbutyl (2Z,4E)-2-cyano-5-phenyl-penta-2,4-dienoate Openeye Name: isopentyl (2Z,4E)-2-cyano-5-phenyl-penta-2,4-dienoate CAS Name: (2Z,4E)-2-cyano-5-phenylpenta-2,4-dienoic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl (2Z,4E)-2-cyano-5-phenylpenta-2,4-dienoate Traditional Name: (2Z,4E)-2-cyano-5-phenyl-penta-2,4-dienoic acid isoamyl ester Formula: C17H19NO2 MolecularWeight: 269.33826

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC(=O)C(=CC=CC1=CC=CC=C1)C#N

Isomeric SMILES

CC(C)CCOC(=O)/C(=C\C=C\C1=CC=CC=C1)/C#N

InChI

InChI=1S/C17H19NO2/c1-14(2)11-12-20-17(19)16(13-18)10-6-9-15-7-4-3-5-8-15/h3-10,14H,11-12H2,1-2H3/b9-6+,16-10-