propyl 4-fluoranyl-2-methyl-3-oxidanylidene-octanoate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)C(C)C(=O)OCCC)F

Isomeric SMILES

CCCCC(C(=O)C(C)C(=O)OCCC)F

InChI

InChI=1S/C12H21FO3/c1-4-6-7-10(13)11(14)9(3)12(15)16-8-5-2/h9-10H,4-8H2,1-3H3