N-cyano-1-piperazin-1-yl-1-(pyridin-3-ylmethylimino)methanamine oxide

Systemtic Name: N-cyano-1-piperazin-1-yl-1-(pyridin-3-ylmethylimino)methanamine oxide Openeye Name: N-cyano-1-piperazin-1-yl-1-(3-pyridylmethylimino)methanamine oxide CAS Name: N-cyano-1-(1-piperazinyl)-1-(3-pyridinylmethylimino)methanamine oxide IUPAC Name: N-cyano-1-piperazin-1-yl-1-(pyridin-3-ylmethylimino)methanamine oxide Traditional Name: N-cyano-1-piperazino-1-(3-pyridylmethylimino)methanamine oxide Formula: C12H16N6O MolecularWeight: 260.29504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C(=NCC2=CN=CC=C2)[NH+](C#N)[O-]

Isomeric SMILES

C1CN(CCN1)C(=NCC2=CN=CC=C2)[NH+](C#N)[O-]

InChI

InChI=1S/C12H16N6O/c13-10-18(19)12(17-6-4-14-5-7-17)16-9-11-2-1-3-15-8-11/h1-3,8,14,18H,4-7,9H2