2-[(2,4-dichlorophenyl)methyl]-1H-1,2,4-triazol-2-ium

Systemtic Name: 2-[(2,4-dichlorophenyl)methyl]-1H-1,2,4-triazol-2-ium Openeye Name: 2-[(2,4-dichlorophenyl)methyl]-1H-1,2,4-triazol-2-ium CAS Name: 2-[(2,4-dichlorophenyl)methyl]-1H-1,2,4-triazol-2-ium IUPAC Name: 2-[(2,4-dichlorophenyl)methyl]-1H-1,2,4-triazol-2-ium Traditional Name: 2-(2,4-dichlorobenzyl)-1H-1,2,4-triazol-2-ium Formula: C9H8Cl2N3+ MolecularWeight: 229.08592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)Cl)C[N+]2=CN=CN2

Isomeric SMILES

C1=CC(=C(C=C1Cl)Cl)C[N+]2=CN=CN2

InChI

InChI=1S/C9H7Cl2N3/c10-8-2-1-7(9(11)3-8)4-14-6-12-5-13-14/h1-3,5-6H,4H2/p+1