ethyl 2-ethanoyl-4,4,4-tris(fluoranyl)-3-(nitromethyl)butanoate

Systemtic Name: ethyl 2-ethanoyl-4,4,4-tris(fluoranyl)-3-(nitromethyl)butanoate Openeye Name: ethyl 2-acetyl-4,4,4-trifluoro-3-(nitromethyl)butanoate CAS Name: 2-acetyl-4,4,4-trifluoro-3-(nitromethyl)butanoic acid ethyl ester IUPAC Name: ethyl 2-acetyl-4,4,4-trifluoro-3-(nitromethyl)butanoate Traditional Name: 2-acetyl-4,4,4-trifluoro-3-(nitromethyl)butyric acid ethyl ester Formula: C9H12F3NO5 MolecularWeight: 271.19049

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C[N+](=O)[O-])C(F)(F)F)C(=O)C

Isomeric SMILES

CCOC(=O)C(C(C[N+](=O)[O-])C(F)(F)F)C(=O)C

InChI

InChI=1S/C9H12F3NO5/c1-3-18-8(15)7(5(2)14)6(4-13(16)17)9(10,11)12/h6-7H,3-4H2,1-2H3