3,3-bis(fluoranylmethyl)-4-nitro-butanenitrile

Systemtic Name: 3,3-bis(fluoranylmethyl)-4-nitro-butanenitrile Openeye Name: 3,3-bis(fluoromethyl)-4-nitro-butanenitrile CAS Name: 3,3-bis(fluoromethyl)-4-nitrobutanenitrile IUPAC Name: 3,3-bis(fluoromethyl)-4-nitrobutanenitrile Traditional Name: 3,3-bis(fluoromethyl)-4-nitro-butyronitrile Formula: C6H8F2N2O2 MolecularWeight: 178.136726

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Descriptors Computed from Structure

Canonical SMILES:

C(C#N)C(C[N+](=O)[O-])(CF)CF

Isomeric SMILES

C(C#N)C(C[N+](=O)[O-])(CF)CF

InChI

InChI=1S/C6H8F2N2O2/c7-3-6(4-8,1-2-9)5-10(11)12/h1,3-5H2