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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CN1C=[N+](C(=CN=O)N1)C.[Cl-]

Isomeric SMILES

CCCCC#CN1C=[N+](/C(=C/N=O)/N1)C.[Cl-]

InChI

InChI=1S/C10H14N4O.ClH/c1-3-4-5-6-7-14-9-13(2)10(12-14)8-11-15;/h8-9H,3-5H2,1-2H3;1H