3-(3-chloranyl-4-fluoranyl-phenyl)sulfonylbutanoic acid

Systemtic Name: 3-(3-chloranyl-4-fluoranyl-phenyl)sulfonylbutanoic acid Openeye Name: 3-(3-chloro-4-fluoro-phenyl)sulfonylbutanoic acid CAS Name: 3-(3-chloro-4-fluorophenyl)sulfonylbutanoic acid IUPAC Name: 3-(3-chloro-4-fluorophenyl)sulfonylbutanoic acid Traditional Name: 3-(3-chloro-4-fluoro-phenyl)sulfonylbutyric acid Formula: C10H10ClFO4S MolecularWeight: 280.700403

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H10ClFO4S/c1-6(4-10(13)14)17(15,16)7-2-3-9(12)8(11)5-7/h2-3,5-6H,4H2,1H3,(H,13,14)