(5E)-4-methyl-5-(nitrosomethylidene)-2-(phenylmethyl)-1H-1,2,4-triazol-4-ium

Systemtic Name: (5E)-4-methyl-5-(nitrosomethylidene)-2-(phenylmethyl)-1H-1,2,4-triazol-4-ium Openeye Name: (5E)-2-benzyl-4-methyl-5-(nitrosomethylene)-1H-1,2,4-triazol-4-ium CAS Name: (5E)-4-methyl-5-(nitrosomethylidene)-2-(phenylmethyl)-1H-1,2,4-triazol-4-ium IUPAC Name: (5E)-2-benzyl-4-methyl-5-(nitrosomethylidene)-1H-1,2,4-triazol-4-ium Traditional Name: (5E)-2-benzyl-4-methyl-5-(nitrosomethylene)-1H-1,2,4-triazol-4-ium Formula: C11H13N4O+ MolecularWeight: 217.24712

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CN(NC1=CN=O)CC2=CC=CC=C2

Isomeric SMILES

C[N+]\1=CN(N/C1=C/N=O)CC2=CC=CC=C2

InChI

InChI=1S/C11H12N4O/c1-14-9-15(13-11(14)7-12-16)8-10-5-3-2-4-6-10/h2-7,9H,8H2,1H3/p+1