(2E)-3,7-dimethylocta-2,6-dienal; ethyl heptanoate

Systemtic Name: (2E)-3,7-dimethylocta-2,6-dienal; ethyl heptanoate Openeye Name: (2E)-3,7-dimethylocta-2,6-dienal; ethyl heptanoate CAS Name: (2E)-3,7-dimethylocta-2,6-dienal; heptanoic acid ethyl ester IUPAC Name: (2E)-3,7-dimethylocta-2,6-dienal; ethyl heptanoate Traditional Name: (2E)-3,7-dimethylocta-2,6-dienal; enanthic acid ethyl ester Formula: C19H34O3 MolecularWeight: 310.47146

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)OCC.CC(=CCCC(=CC=O)C)C

Isomeric SMILES

CCCCCCC(=O)OCC.CC(=CCC/C(=C/C=O)/C)C

InChI

InChI=1S/C10H16O.C9H18O2/c1-9(2)5-4-6-10(3)7-8-11;1-3-5-6-7-8-9(10)11-4-2/h5,7-8H,4,6H2,1-3H3;3-8H2,1-2H3/b10-7+;