3-methylbutyl (2E,4E)-3,7,11-trimethyldodeca-2,4-dienoate

Systemtic Name: 3-methylbutyl (2E,4E)-3,7,11-trimethyldodeca-2,4-dienoate Openeye Name: isopentyl (2E,4E)-3,7,11-trimethyldodeca-2,4-dienoate CAS Name: (2E,4E)-3,7,11-trimethyldodeca-2,4-dienoic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl (2E,4E)-3,7,11-trimethyldodeca-2,4-dienoate Traditional Name: (2E,4E)-3,7,11-trimethyldodeca-2,4-dienoic acid isoamyl ester Formula: C20H36O2 MolecularWeight: 308.49864

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)CC=CC(=CC(=O)OCCC(C)C)C

Isomeric SMILES

CC(C)CCCC(C)C/C=C/C(=C/C(=O)OCCC(C)C)/C

InChI

InChI=1S/C20H36O2/c1-16(2)9-7-10-18(5)11-8-12-19(6)15-20(21)22-14-13-17(3)4/h8,12,15-18H,7,9-11,13-14H2,1-6H3/b12-8+,19-15+