(3,3-dimethyl-2-oxidanylidene-butyl) 2,5-dimethylfuran-3-carboxylate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 2,5-dimethylfuran-3-carboxylate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 2,5-dimethylfuran-3-carboxylate CAS Name: 2,5-dimethyl-3-furancarboxylic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 2,5-dimethylfuran-3-carboxylate Traditional Name: 2,5-dimethylfuran-3-carboxylic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C13H18O4 MolecularWeight: 238.27962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(O1)C)C(=O)OCC(=O)C(C)(C)C

Isomeric SMILES

CC1=CC(=C(O1)C)C(=O)OCC(=O)C(C)(C)C

InChI

InChI=1S/C13H18O4/c1-8-6-10(9(2)17-8)12(15)16-7-11(14)13(3,4)5/h6H,7H2,1-5H3