methyl 4,4,4-tris(fluoranyl)-3-(nitromethyl)butanoate

Systemtic Name: methyl 4,4,4-tris(fluoranyl)-3-(nitromethyl)butanoate Openeye Name: methyl 4,4,4-trifluoro-3-(nitromethyl)butanoate CAS Name: 4,4,4-trifluoro-3-(nitromethyl)butanoic acid methyl ester IUPAC Name: methyl 4,4,4-trifluoro-3-(nitromethyl)butanoate Traditional Name: 4,4,4-trifluoro-3-(nitromethyl)butyric acid methyl ester Formula: C6H8F3NO4 MolecularWeight: 215.12723

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

COC(=O)CC(C[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C6H8F3NO4/c1-14-5(11)2-4(3-10(12)13)6(7,8)9/h4H,2-3H2,1H3