5-(4-pyrrolidin-1-ium-1-ylbutylamino)-2H-1,2,4-triazin-3-one

Systemtic Name: 5-(4-pyrrolidin-1-ium-1-ylbutylamino)-2H-1,2,4-triazin-3-one Openeye Name: 5-(4-pyrrolidin-1-ium-1-ylbutylamino)-2H-1,2,4-triazin-3-one CAS Name: 5-[4-(1-pyrrolidin-1-iumyl)butylamino]-2H-1,2,4-triazin-3-one IUPAC Name: 5-(4-pyrrolidin-1-ium-1-ylbutylamino)-2H-1,2,4-triazin-3-one Traditional Name: 5-(4-pyrrolidin-1-ium-1-ylbutylamino)-2H-1,2,4-triazin-3-one Formula: C11H20N5O+ MolecularWeight: 238.3094

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCCCNC2=NC(=O)NN=C2

Isomeric SMILES

C1CC[NH+](C1)CCCCNC2=NC(=O)NN=C2

InChI

InChI=1S/C11H19N5O/c17-11-14-10(9-13-15-11)12-5-1-2-6-16-7-3-4-8-16/h9H,1-8H2,(H2,12,14,15,17)/p+1