1-(5-iodanyl-2-methyl-phenyl)sulfonylbenzotriazole

Systemtic Name: 1-(5-iodanyl-2-methyl-phenyl)sulfonylbenzotriazole Openeye Name: 1-(5-iodo-2-methyl-phenyl)sulfonylbenzotriazole CAS Name: 1-(5-iodo-2-methylphenyl)sulfonylbenzotriazole IUPAC Name: 1-(5-iodo-2-methylphenyl)sulfonylbenzotriazole Traditional Name: 1-(5-iodo-2-methyl-phenyl)sulfonylbenzotriazole Formula: C13H10IN3O2S MolecularWeight: 399.20687

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)I)S(=O)(=O)N2C3=CC=CC=C3N=N2

Isomeric SMILES

CC1=C(C=C(C=C1)I)S(=O)(=O)N2C3=CC=CC=C3N=N2

InChI

InChI=1S/C13H10IN3O2S/c1-9-6-7-10(14)8-13(9)20(18,19)17-12-5-3-2-4-11(12)15-16-17/h2-8H,1H3