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

Systemtic Name: 4,4,4-tris(fluoranyl)-3-methyl-3-(nitromethyl)butanenitrile Openeye Name: 4,4,4-trifluoro-3-methyl-3-(nitromethyl)butanenitrile CAS Name: 4,4,4-trifluoro-3-methyl-3-(nitromethyl)butanenitrile IUPAC Name: 4,4,4-trifluoro-3-methyl-3-(nitromethyl)butanenitrile Traditional Name: 4,4,4-trifluoro-3-methyl-3-(nitromethyl)butyronitrile Formula: C6H7F3N2O2 MolecularWeight: 196.12719

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H7F3N2O2/c1-5(2-3-10,4-11(12)13)6(7,8)9/h2,4H2,1H3