[2-azanyl-4-(diethylamino)-6-ethyl-1,3,5-triazin-1-ium-1-yl] hydrogen sulfate hydroxide

Systemtic Name: [2-azanyl-4-(diethylamino)-6-ethyl-1,3,5-triazin-1-ium-1-yl] hydrogen sulfate hydroxide Openeye Name: [2-amino-4-(diethylamino)-6-ethyl-1,3,5-triazin-1-ium-1-yl] hydrogen sulfate hydroxide CAS Name: sulfuric acid [2-amino-4-(diethylamino)-6-ethyl-1,3,5-triazin-1-ium-1-yl] ester hydroxide IUPAC Name: [2-amino-4-(diethylamino)-6-ethyl-1,3,5-triazin-1-ium-1-yl] hydrogen sulfate hydroxide Traditional Name: sulfuric acid [2-amino-4-(diethylamino)-6-ethyl-s-triazin-1-ium-1-yl] ester hydroxide Formula: C9H19N5O5S MolecularWeight: 309.34266

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=NC(=[N+]1OS(=O)(=O)O)N)N(CC)CC.[OH-]

Isomeric SMILES

CCC1=NC(=NC(=[N+]1OS(=O)(=O)O)N)N(CC)CC.[OH-]

InChI

InChI=1S/C9H17N5O4S.H2O/c1-4-7-11-9(13(5-2)6-3)12-8(10)14(7)18-19(15,16)17;/h10H,4-6H2,1-3H3,(H,15,16,17);1H2