3,4,4-trimethyl-3-(nitromethyl)pentanenitrile

Systemtic Name: 3,4,4-trimethyl-3-(nitromethyl)pentanenitrile Openeye Name: 3,4,4-trimethyl-3-(nitromethyl)pentanenitrile CAS Name: 3,4,4-trimethyl-3-(nitromethyl)pentanenitrile IUPAC Name: 3,4,4-trimethyl-3-(nitromethyl)pentanenitrile Traditional Name: 3,4,4-trimethyl-3-(nitromethyl)valeronitrile Formula: C9H16N2O2 MolecularWeight: 184.23554

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H16N2O2/c1-8(2,3)9(4,5-6-10)7-11(12)13/h5,7H2,1-4H3