1-(2,5-dimethylfuran-3-yl)octane-1,3-dione

Systemtic Name: 1-(2,5-dimethylfuran-3-yl)octane-1,3-dione Openeye Name: 1-(2,5-dimethyl-3-furyl)octane-1,3-dione CAS Name: 1-(2,5-dimethyl-3-furanyl)octane-1,3-dione IUPAC Name: 1-(2,5-dimethylfuran-3-yl)octane-1,3-dione Traditional Name: 1-(2,5-dimethyl-3-furyl)octane-1,3-dione Formula: C14H20O3 MolecularWeight: 236.3068

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)CC(=O)C1=C(OC(=C1)C)C

Isomeric SMILES

CCCCCC(=O)CC(=O)C1=C(OC(=C1)C)C

InChI

InChI=1S/C14H20O3/c1-4-5-6-7-12(15)9-14(16)13-8-10(2)17-11(13)3/h8H,4-7,9H2,1-3H3