methyl 2,3,6,6-tetramethyl-5-oxidanylidene-heptanoate

Systemtic Name: methyl 2,3,6,6-tetramethyl-5-oxidanylidene-heptanoate Openeye Name: methyl 2,3,6,6-tetramethyl-5-oxo-heptanoate CAS Name: 2,3,6,6-tetramethyl-5-oxoheptanoic acid methyl ester IUPAC Name: methyl 2,3,6,6-tetramethyl-5-oxoheptanoate Traditional Name: 5-keto-2,3,6,6-tetramethyl-enanthic acid methyl ester Formula: C12H22O3 MolecularWeight: 214.30128

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)C(C)(C)C)C(C)C(=O)OC

Isomeric SMILES

CC(CC(=O)C(C)(C)C)C(C)C(=O)OC

InChI

InChI=1S/C12H22O3/c1-8(9(2)11(14)15-6)7-10(13)12(3,4)5/h8-9H,7H2,1-6H3