N,N-bis(cyanomethyl)-2-piperazin-4-ium-1-yl-ethanamide

Systemtic Name: N,N-bis(cyanomethyl)-2-piperazin-4-ium-1-yl-ethanamide Openeye Name: N,N-bis(cyanomethyl)-2-piperazin-4-ium-1-yl-acetamide CAS Name: N,N-bis(cyanomethyl)-2-(1-piperazin-4-iumyl)acetamide IUPAC Name: N,N-bis(cyanomethyl)-2-piperazin-4-ium-1-ylacetamide Traditional Name: N,N-bis(cyanomethyl)-2-piperazin-4-ium-1-yl-acetamide Formula: C10H16N5O+ MolecularWeight: 222.26694

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)CC(=O)N(CC#N)CC#N

Isomeric SMILES

C1CN(CC[NH2+]1)CC(=O)N(CC#N)CC#N

InChI

InChI=1S/C10H15N5O/c11-1-5-15(6-2-12)10(16)9-14-7-3-13-4-8-14/h13H,3-9H2/p+1