propan-2-yl 4-fluoranyl-2-methyl-3-oxidanylidene-octanoate

Systemtic Name: propan-2-yl 4-fluoranyl-2-methyl-3-oxidanylidene-octanoate Openeye Name: isopropyl 4-fluoro-2-methyl-3-oxo-octanoate CAS Name: 4-fluoro-2-methyl-3-oxooctanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-fluoro-2-methyl-3-oxooctanoate Traditional Name: 4-fluoro-3-keto-2-methyl-caprylic acid isopropyl ester Formula: C12H21FO3 MolecularWeight: 232.291743

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)C(C)C(=O)OC(C)C)F

Isomeric SMILES

CCCCC(C(=O)C(C)C(=O)OC(C)C)F

InChI

InChI=1S/C12H21FO3/c1-5-6-7-10(13)11(14)9(4)12(15)16-8(2)3/h8-10H,5-7H2,1-4H3