(2S)-2-(nitromethyl)butanenitrile

Systemtic Name: (2S)-2-(nitromethyl)butanenitrile Openeye Name: (2S)-2-(nitromethyl)butanenitrile CAS Name: (2S)-2-(nitromethyl)butanenitrile IUPAC Name: (2S)-2-(nitromethyl)butanenitrile Traditional Name: (2S)-2-(nitromethyl)butyronitrile Formula: C5H8N2O2 MolecularWeight: 128.12922

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C5H8N2O2/c1-2-5(3-6)4-7(8)9/h5H,2,4H2,1H3/t5-/m1/s1