3-chloranyl-2,6-dimethyl-benzenecarboperoxoic acid

Systemtic Name: 3-chloranyl-2,6-dimethyl-benzenecarboperoxoic acid Openeye Name: 3-chloro-2,6-dimethyl-benzenecarboperoxoic acid CAS Name: 3-chloro-2,6-dimethylbenzenecarboperoxoic acid IUPAC Name: 3-chloro-2,6-dimethylbenzenecarboperoxoic acid Traditional Name: 3-chloro-2,6-dimethyl-perbenzoic acid Formula: C9H9ClO3 MolecularWeight: 200.61896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)Cl)C)C(=O)OO

Isomeric SMILES

CC1=C(C(=C(C=C1)Cl)C)C(=O)OO

InChI

InChI=1S/C9H9ClO3/c1-5-3-4-7(10)6(2)8(5)9(11)13-12/h3-4,12H,1-2H3