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methyl 3-oxidanylidene-2-(trifluoromethyl)heptanoate

methyl 3-oxidanylidene-2-(trifluoromethyl)heptanoate

Systemtic Name:methyl 3-oxidanylidene-2-(trifluoromethyl)heptanoate
Openeye Name:methyl 3-oxo-2-(trifluoromethyl)heptanoate
CAS Name:3-oxo-2-(trifluoromethyl)heptanoic acid methyl ester
IUPAC Name:methyl 3-oxo-2-(trifluoromethyl)heptanoate
Traditional Name:3-keto-2-(trifluoromethyl)enanthic acid methyl ester
Formula: C9H13F3O3
MolecularWeight: 226.19293
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C9H13F3O3/c1-3-4-5-6(13)7(8(14)15-2)9(10,11)12/h7H,3-5H2,1-2H3


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