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

Systemtic Name: 2-ethylhexyl (2E,4E)-2-ethanoyl-5-phenyl-penta-2,4-dienoate Openeye Name: 2-ethylhexyl (2E,4E)-2-acetyl-5-phenyl-penta-2,4-dienoate CAS Name: (2E,4E)-2-acetyl-5-phenylpenta-2,4-dienoic acid 2-ethylhexyl ester IUPAC Name: 2-ethylhexyl (2E,4E)-2-acetyl-5-phenylpenta-2,4-dienoate Traditional Name: (2E,4E)-2-acetyl-5-phenyl-penta-2,4-dienoic acid 2-ethylhexyl ester Formula: C21H28O3 MolecularWeight: 328.44522

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28O3/c1-4-6-11-18(5-2)16-24-21(23)20(17(3)22)15-10-14-19-12-8-7-9-13-19/h7-10,12-15,18H,4-6,11,16H2,1-3H3/b14-10+,20-15+