6-ethyl-3-piperazin-4-ium-1-yl-5-piperidin-1-yl-1,2,4-triazin-4-ium

Systemtic Name: 6-ethyl-3-piperazin-4-ium-1-yl-5-piperidin-1-yl-1,2,4-triazin-4-ium Openeye Name: 6-ethyl-3-piperazin-4-ium-1-yl-5-(1-piperidyl)-1,2,4-triazin-4-ium CAS Name: 6-ethyl-3-(1-piperazin-4-iumyl)-5-(1-piperidinyl)-1,2,4-triazin-4-ium IUPAC Name: 6-ethyl-3-piperazin-4-ium-1-yl-5-piperidin-1-yl-1,2,4-triazin-4-ium Traditional Name: 6-ethyl-3-piperazin-4-ium-1-yl-5-piperidino-1,2,4-triazin-4-ium Formula: C14H26N6+2 MolecularWeight: 278.39644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C([NH+]=C(N=N1)N2CC[NH2+]CC2)N3CCCCC3

Isomeric SMILES

CCC1=C([NH+]=C(N=N1)N2CC[NH2+]CC2)N3CCCCC3

InChI

InChI=1S/C14H24N6/c1-2-12-13(19-8-4-3-5-9-19)16-14(18-17-12)20-10-6-15-7-11-20/h15H,2-11H2,1H3/p+2