1-ethanoyl-4-piperazin-4-ium-1-yl-piperidine-4-carbonitrile

Systemtic Name: 1-ethanoyl-4-piperazin-4-ium-1-yl-piperidine-4-carbonitrile Openeye Name: 1-acetyl-4-piperazin-4-ium-1-yl-piperidine-4-carbonitrile CAS Name: 1-acetyl-4-(1-piperazin-4-iumyl)-4-piperidinecarbonitrile IUPAC Name: 1-acetyl-4-piperazin-4-ium-1-ylpiperidine-4-carbonitrile Traditional Name: 1-acetyl-4-piperazin-4-ium-1-yl-isonipecotonitrile Formula: C12H21N4O+ MolecularWeight: 237.32134

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC(CC1)(C#N)N2CC[NH2+]CC2

Isomeric SMILES

CC(=O)N1CCC(CC1)(C#N)N2CC[NH2+]CC2

InChI

InChI=1S/C12H20N4O/c1-11(17)15-6-2-12(10-13,3-7-15)16-8-4-14-5-9-16/h14H,2-9H2,1H3/p+1