(2,5-dimethyl-4-oxidanylidene-furan-3-yl) hexanoate

Systemtic Name: (2,5-dimethyl-4-oxidanylidene-furan-3-yl) hexanoate Openeye Name: (2,5-dimethyl-4-oxo-3-furyl) hexanoate CAS Name: hexanoic acid (2,5-dimethyl-4-oxo-3-furanyl) ester IUPAC Name: (2,5-dimethyl-4-oxofuran-3-yl) hexanoate Traditional Name: hexanoic acid (4-keto-2,5-dimethyl-3-furyl) ester Formula: C12H18O4 MolecularWeight: 226.26892

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)OC1=C(OC(C1=O)C)C

Isomeric SMILES

CCCCCC(=O)OC1=C(OC(C1=O)C)C

InChI

InChI=1S/C12H18O4/c1-4-5-6-7-10(13)16-12-9(3)15-8(2)11(12)14/h8H,4-7H2,1-3H3