3-(chloromethyl)-6-(4-methylphenyl)-4-oxidanidyl-1,2,4-triazin-4-ium

Systemtic Name: 3-(chloromethyl)-6-(4-methylphenyl)-4-oxidanidyl-1,2,4-triazin-4-ium Openeye Name: 3-(chloromethyl)-4-oxido-6-(p-tolyl)-1,2,4-triazin-4-ium CAS Name: 3-(chloromethyl)-6-(4-methylphenyl)-4-oxido-1,2,4-triazin-4-ium IUPAC Name: 3-(chloromethyl)-6-(4-methylphenyl)-4-oxido-1,2,4-triazin-4-ium Traditional Name: 3-(chloromethyl)-4-oxido-6-(p-tolyl)-1,2,4-triazin-4-ium Formula: C11H10ClN3O MolecularWeight: 235.6696

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C[N+](=C(N=N2)CCl)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=C[N+](=C(N=N2)CCl)[O-]

InChI

InChI=1S/C11H10ClN3O/c1-8-2-4-9(5-3-8)10-7-15(16)11(6-12)14-13-10/h2-5,7H,6H2,1H3