(4-azanyl-5-oxidanylidene-3-propan-2-yl-1,2,4-triazol-1-yl)carbonyl-ethyl-dimethyl-azanium

Systemtic Name: (4-azanyl-5-oxidanylidene-3-propan-2-yl-1,2,4-triazol-1-yl)carbonyl-ethyl-dimethyl-azanium Openeye Name: (4-amino-3-isopropyl-5-oxo-1,2,4-triazole-1-carbonyl)-ethyl-dimethyl-ammonium CAS Name: [(4-amino-5-oxo-3-propan-2-yl-1,2,4-triazol-1-yl)-oxomethyl]-ethyl-dimethylammonium IUPAC Name: (4-amino-5-oxo-3-propan-2-yl-1,2,4-triazole-1-carbonyl)-ethyl-dimethylazanium Traditional Name: (4-amino-3-isopropyl-5-keto-1,2,4-triazole-1-carbonyl)-ethyl-dimethyl-ammonium Formula: C10H20N5O2+ MolecularWeight: 242.2981

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](C)(C)C(=O)N1C(=O)N(C(=N1)C(C)C)N

Isomeric SMILES

CC[N+](C)(C)C(=O)N1C(=O)N(C(=N1)C(C)C)N

InChI

InChI=1S/C10H20N5O2/c1-6-15(4,5)10(17)14-9(16)13(11)8(12-14)7(2)3/h7H,6,11H2,1-5H3/q+1