3-phenyl-1,2,3,4-oxatriazol-3-ium-5-amine chloride

Systemtic Name: 3-phenyl-1,2,3,4-oxatriazol-3-ium-5-amine chloride Openeye Name: 3-phenyloxatriazol-3-ium-5-amine chloride CAS Name: 3-phenyl-5-oxatriazol-3-iumamine chloride IUPAC Name: 3-phenyloxatriazol-3-ium-5-amine chloride Traditional Name: (3-phenyloxatriazol-3-ium-5-yl)amine chloride Formula: C7H7ClN4O MolecularWeight: 198.60968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[N+]2=NOC(=N2)N.[Cl-]

Isomeric SMILES

C1=CC=C(C=C1)[N+]2=NOC(=N2)N.[Cl-]

InChI

InChI=1S/C7H7N4O.ClH/c8-7-9-11(10-12-7)6-4-2-1-3-5-6;/h1-5H,(H2,8,9,10);1H/q+1;/p-1