methyl 2,2-dimethyl-3-(2-oxidanylidenepropyl)octanoate

Systemtic Name: methyl 2,2-dimethyl-3-(2-oxidanylidenepropyl)octanoate Openeye Name: methyl 3-acetonyl-2,2-dimethyl-octanoate CAS Name: 2,2-dimethyl-3-(2-oxopropyl)octanoic acid methyl ester IUPAC Name: methyl 2,2-dimethyl-3-(2-oxopropyl)octanoate Traditional Name: 3-acetonyl-2,2-dimethyl-caprylic acid methyl ester Formula: C14H26O3 MolecularWeight: 242.35444

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H26O3/c1-6-7-8-9-12(10-11(2)15)14(3,4)13(16)17-5/h12H,6-10H2,1-5H3