(5Z)-2-hex-5-ynyl-4-methyl-5-(nitrosomethylidene)-1H-1,2,4-triazol-4-ium chloride

Systemtic Name: (5Z)-2-hex-5-ynyl-4-methyl-5-(nitrosomethylidene)-1H-1,2,4-triazol-4-ium chloride Openeye Name: (5Z)-2-hex-5-ynyl-4-methyl-5-(nitrosomethylene)-1H-1,2,4-triazol-4-ium chloride CAS Name: (5Z)-2-hex-5-ynyl-4-methyl-5-(nitrosomethylidene)-1H-1,2,4-triazol-4-ium chloride IUPAC Name: (5Z)-2-hex-5-ynyl-4-methyl-5-(nitrosomethylidene)-1H-1,2,4-triazol-4-ium chloride Traditional Name: (5Z)-2-hex-5-ynyl-4-methyl-5-(nitrosomethylene)-1H-1,2,4-triazol-4-ium chloride Formula: C10H15ClN4O MolecularWeight: 242.7053

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CN(NC1=CN=O)CCCCC#C.[Cl-]

Isomeric SMILES

C[N+]\1=CN(N/C1=C\N=O)CCCCC#C.[Cl-]

InChI

InChI=1S/C10H14N4O.ClH/c1-3-4-5-6-7-14-9-13(2)10(12-14)8-11-15;/h1,8-9H,4-7H2,2H3;1H