5-chloranyl-6-methyl-1-oxidanyl-benzotriazole

Systemtic Name: 5-chloranyl-6-methyl-1-oxidanyl-benzotriazole Openeye Name: 5-chloro-1-hydroxy-6-methyl-benzotriazole CAS Name: 5-chloro-1-hydroxy-6-methylbenzotriazole IUPAC Name: 5-chloro-1-hydroxy-6-methylbenzotriazole Traditional Name: 5-chloro-1-hydroxy-6-methyl-benzotriazole Formula: C7H6ClN3O MolecularWeight: 183.59504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1Cl)N=NN2O

Isomeric SMILES

CC1=CC2=C(C=C1Cl)N=NN2O

InChI

InChI=1S/C7H6ClN3O/c1-4-2-7-6(3-5(4)8)9-10-11(7)12/h2-3,12H,1H3