3-[(4-azanyl-6-tert-butyl-5-oxidanylidene-2H-1,2,4-triazin-4-ium-3-yl)amino]propyl-dimethyl-azanium

Systemtic Name: 3-[(4-azanyl-6-tert-butyl-5-oxidanylidene-2H-1,2,4-triazin-4-ium-3-yl)amino]propyl-dimethyl-azanium Openeye Name: 3-[(4-amino-6-tert-butyl-5-oxo-2H-1,2,4-triazin-4-ium-3-yl)amino]propyl-dimethyl-ammonium CAS Name: 3-[(4-amino-6-tert-butyl-5-oxo-2H-1,2,4-triazin-4-ium-3-yl)amino]propyl-dimethylammonium IUPAC Name: 3-[(4-amino-6-tert-butyl-5-oxo-2H-1,2,4-triazin-4-ium-3-yl)amino]propyl-dimethylazanium Traditional Name: 3-[(4-amino-6-tert-butyl-5-keto-2H-1,2,4-triazin-4-ium-3-yl)amino]propyl-dimethyl-ammonium Formula: C12H26N6O+2 MolecularWeight: 270.37444

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NNC(=[N+](C1=O)N)NCCC[NH+](C)C

Isomeric SMILES

CC(C)(C)C1=NNC(=[N+](C1=O)N)NCCC[NH+](C)C

InChI

InChI=1S/C12H24N6O/c1-12(2,3)9-10(19)18(13)11(16-15-9)14-7-6-8-17(4)5/h6-8,13H2,1-5H3,(H,14,16,19)/p+2