3,7-dimethylocta-1,6-dien-3-yl ethanoate; heptan-2-one

Systemtic Name: 3,7-dimethylocta-1,6-dien-3-yl ethanoate; heptan-2-one Openeye Name: (1,5-dimethyl-1-vinyl-hex-4-enyl) acetate; heptan-2-one CAS Name: acetic acid 3,7-dimethylocta-1,6-dien-3-yl ester; 2-heptanone IUPAC Name: 3,7-dimethylocta-1,6-dien-3-yl acetate; heptan-2-one Traditional Name: acetic acid (1,5-dimethyl-1-vinyl-hex-4-enyl) ester; heptan-2-one Formula: C19H34O3 MolecularWeight: 310.47146

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)C.CC(=CCCC(C)(C=C)OC(=O)C)C

Isomeric SMILES

CCCCCC(=O)C.CC(=CCCC(C)(C=C)OC(=O)C)C

InChI

InChI=1S/C12H20O2.C7H14O/c1-6-12(5,14-11(4)13)9-7-8-10(2)3;1-3-4-5-6-7(2)8/h6,8H,1,7,9H2,2-5H3;3-6H2,1-2H3