4-(4-chloranylsulfonyl-2,6-dimethyl-phenoxy)butanoic acid

Systemtic Name: 4-(4-chloranylsulfonyl-2,6-dimethyl-phenoxy)butanoic acid Openeye Name: 4-(4-chlorosulfonyl-2,6-dimethyl-phenoxy)butanoic acid CAS Name: 4-(4-chlorosulfonyl-2,6-dimethylphenoxy)butanoic acid IUPAC Name: 4-(4-chlorosulfonyl-2,6-dimethylphenoxy)butanoic acid Traditional Name: 4-(4-chlorosulfonyl-2,6-dimethyl-phenoxy)butyric acid Formula: C12H15ClO5S MolecularWeight: 306.7625

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCCCC(=O)O)C)S(=O)(=O)Cl

Isomeric SMILES

CC1=CC(=CC(=C1OCCCC(=O)O)C)S(=O)(=O)Cl

InChI

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