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

Systemtic Name: 6-ethyl-3-piperazin-4-ium-1-yl-5-pyrrolidin-1-yl-1,2,4-triazin-4-ium Openeye Name: 6-ethyl-3-piperazin-4-ium-1-yl-5-pyrrolidin-1-yl-1,2,4-triazin-4-ium CAS Name: 6-ethyl-3-(1-piperazin-4-iumyl)-5-(1-pyrrolidinyl)-1,2,4-triazin-4-ium IUPAC Name: 6-ethyl-3-piperazin-4-ium-1-yl-5-pyrrolidin-1-yl-1,2,4-triazin-4-ium Traditional Name: 6-ethyl-3-piperazin-4-ium-1-yl-5-pyrrolidino-1,2,4-triazin-4-ium Formula: C13H24N6+2 MolecularWeight: 264.36986

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C([NH+]=C(N=N1)N2CC[NH2+]CC2)N3CCCC3

Isomeric SMILES

CCC1=C([NH+]=C(N=N1)N2CC[NH2+]CC2)N3CCCC3

InChI

InChI=1S/C13H22N6/c1-2-11-12(18-7-3-4-8-18)15-13(17-16-11)19-9-5-14-6-10-19/h14H,2-10H2,1H3/p+2