4-(4-chloranylsulfonyl-3,5-dimethyl-phenoxy)butanoic acid

Systemtic Name: 4-(4-chloranylsulfonyl-3,5-dimethyl-phenoxy)butanoic acid Openeye Name: 4-(4-chlorosulfonyl-3,5-dimethyl-phenoxy)butanoic acid CAS Name: 4-(4-chlorosulfonyl-3,5-dimethylphenoxy)butanoic acid IUPAC Name: 4-(4-chlorosulfonyl-3,5-dimethylphenoxy)butanoic acid Traditional Name: 4-(4-chlorosulfonyl-3,5-dimethyl-phenoxy)butyric acid Formula: C12H15ClO5S MolecularWeight: 306.7625

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1S(=O)(=O)Cl)C)OCCCC(=O)O

Isomeric SMILES

CC1=CC(=CC(=C1S(=O)(=O)Cl)C)OCCCC(=O)O

InChI

InChI=1S/C12H15ClO5S/c1-8-6-10(18-5-3-4-11(14)15)7-9(2)12(8)19(13,16)17/h6-7H,3-5H2,1-2H3,(H,14,15)