4-(4-chloranylsulfonyl-2-propan-2-yl-phenoxy)butanoic acid

Systemtic Name: 4-(4-chloranylsulfonyl-2-propan-2-yl-phenoxy)butanoic acid Openeye Name: 4-(4-chlorosulfonyl-2-isopropyl-phenoxy)butanoic acid CAS Name: 4-(4-chlorosulfonyl-2-propan-2-ylphenoxy)butanoic acid IUPAC Name: 4-(4-chlorosulfonyl-2-propan-2-ylphenoxy)butanoic acid Traditional Name: 4-(4-chlorosulfonyl-2-isopropyl-phenoxy)butyric acid Formula: C13H17ClO5S MolecularWeight: 320.78908

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=CC(=C1)S(=O)(=O)Cl)OCCCC(=O)O

Isomeric SMILES

CC(C)C1=C(C=CC(=C1)S(=O)(=O)Cl)OCCCC(=O)O

InChI

InChI=1S/C13H17ClO5S/c1-9(2)11-8-10(20(14,17)18)5-6-12(11)19-7-3-4-13(15)16/h5-6,8-9H,3-4,7H2,1-2H3,(H,15,16)