5,5,5-tris(fluoranyl)-4-methyl-4-nitro-pentanenitrile

Systemtic Name: 5,5,5-tris(fluoranyl)-4-methyl-4-nitro-pentanenitrile Openeye Name: 5,5,5-trifluoro-4-methyl-4-nitro-pentanenitrile CAS Name: 5,5,5-trifluoro-4-methyl-4-nitropentanenitrile IUPAC Name: 5,5,5-trifluoro-4-methyl-4-nitropentanenitrile Traditional Name: 5,5,5-trifluoro-4-methyl-4-nitro-valeronitrile Formula: C6H7F3N2O2 MolecularWeight: 196.12719

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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