3-(2-chloranyl-6-methyl-4-methylsulfonyl-phenoxy)benzoic acid

Systemtic Name: 3-(2-chloranyl-6-methyl-4-methylsulfonyl-phenoxy)benzoic acid Openeye Name: 3-(2-chloro-6-methyl-4-methylsulfonyl-phenoxy)benzoic acid CAS Name: 3-(2-chloro-6-methyl-4-methylsulfonylphenoxy)benzoic acid IUPAC Name: 3-(2-chloro-6-methyl-4-methylsulfonylphenoxy)benzoic acid Traditional Name: 3-(2-chloro-4-mesyl-6-methyl-phenoxy)benzoic acid Formula: C15H13ClO5S MolecularWeight: 340.77872

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC2=CC=CC(=C2)C(=O)O)Cl)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=CC(=C1OC2=CC=CC(=C2)C(=O)O)Cl)S(=O)(=O)C

InChI

InChI=1S/C15H13ClO5S/c1-9-6-12(22(2,19)20)8-13(16)14(9)21-11-5-3-4-10(7-11)15(17)18/h3-8H,1-2H3,(H,17,18)