O6-[(1E)-buta-1,3-dienyl] O1-(2-ethylhexyl) (2E,4E)-2-methylhexa-2,4-dienedioate

Systemtic Name: O6-[(1E)-buta-1,3-dienyl] O1-(2-ethylhexyl) (2E,4E)-2-methylhexa-2,4-dienedioate Openeye Name: O6-[(1E)-buta-1,3-dienyl] O1-(2-ethylhexyl) (2E,4E)-2-methylhexa-2,4-dienedioate CAS Name: (2E,4E)-2-methylhexa-2,4-dienedioic acid O6-[(1E)-buta-1,3-dienyl] ester O1-(2-ethylhexyl) ester IUPAC Name: 6-O-[(1E)-buta-1,3-dienyl] 1-O-(2-ethylhexyl) (2E,4E)-2-methylhexa-2,4-dienedioate Traditional Name: (2E,4E)-2-methylmuconic acid O6-[(1E)-buta-1,3-dienyl] ester O1-(2-ethylhexyl) ester Formula: C19H28O4 MolecularWeight: 320.42322

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC(=O)C(=CC=CC(=O)OC=CC=C)C

Isomeric SMILES

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

InChI

InChI=1S/C19H28O4/c1-5-8-12-17(7-3)15-23-19(21)16(4)11-10-13-18(20)22-14-9-6-2/h6,9-11,13-14,17H,2,5,7-8,12,15H2,1,3-4H3/b13-10+,14-9+,16-11+