4-(2-chloranylsulfonyl-4-methyl-phenoxy)butanoic acid

Systemtic Name: 4-(2-chloranylsulfonyl-4-methyl-phenoxy)butanoic acid Openeye Name: 4-(2-chlorosulfonyl-4-methyl-phenoxy)butanoic acid CAS Name: 4-(2-chlorosulfonyl-4-methylphenoxy)butanoic acid IUPAC Name: 4-(2-chlorosulfonyl-4-methylphenoxy)butanoic acid Traditional Name: 4-(2-chlorosulfonyl-4-methyl-phenoxy)butyric acid Formula: C11H13ClO5S MolecularWeight: 292.73592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCCCC(=O)O)S(=O)(=O)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)OCCCC(=O)O)S(=O)(=O)Cl

InChI

InChI=1S/C11H13ClO5S/c1-8-4-5-9(10(7-8)18(12,15)16)17-6-2-3-11(13)14/h4-5,7H,2-3,6H2,1H3,(H,13,14)