N-cyano-1-(3,3-dimethylbutan-2-ylimino)-1-(pyridin-4-ylamino)methanamine oxide

Systemtic Name: N-cyano-1-(3,3-dimethylbutan-2-ylimino)-1-(pyridin-4-ylamino)methanamine oxide Openeye Name: N-cyano-1-(4-pyridylamino)-1-(1,2,2-trimethylpropylimino)methanamine oxide CAS Name: N-cyano-1-(3,3-dimethylbutan-2-ylimino)-1-(pyridin-4-ylamino)methanamine oxide IUPAC Name: N-cyano-1-(3,3-dimethylbutan-2-ylimino)-1-(pyridin-4-ylamino)methanamine oxide Traditional Name: N-cyano-1-(4-pyridylamino)-1-(1,2,2-trimethylpropylimino)methanamine oxide Formula: C13H19N5O MolecularWeight: 261.32286

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C)(C)C)N=C(NC1=CC=NC=C1)[NH+](C#N)[O-]

Isomeric SMILES

CC(C(C)(C)C)N=C(NC1=CC=NC=C1)[NH+](C#N)[O-]

InChI

InChI=1S/C13H19N5O/c1-10(13(2,3)4)16-12(18(19)9-14)17-11-5-7-15-8-6-11/h5-8,10,18H,1-4H3,(H,15,16,17)