3-iodanyl-4-methyl-5-phenyl-1,2,4-triazole

Systemtic Name: 3-iodanyl-4-methyl-5-phenyl-1,2,4-triazole Openeye Name: 3-iodo-4-methyl-5-phenyl-1,2,4-triazole CAS Name: 3-iodo-4-methyl-5-phenyl-1,2,4-triazole IUPAC Name: 3-iodo-4-methyl-5-phenyl-1,2,4-triazole Traditional Name: 3-iodo-4-methyl-5-phenyl-1,2,4-triazole Formula: C9H8IN3 MolecularWeight: 285.08439

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1I)C2=CC=CC=C2

Isomeric SMILES

CN1C(=NN=C1I)C2=CC=CC=C2

InChI

InChI=1S/C9H8IN3/c1-13-8(11-12-9(13)10)7-5-3-2-4-6-7/h2-6H,1H3