2-(3-chloranyl-4-fluoranyl-phenyl)sulfonylbutanoic acid

Systemtic Name: 2-(3-chloranyl-4-fluoranyl-phenyl)sulfonylbutanoic acid Openeye Name: 2-(3-chloro-4-fluoro-phenyl)sulfonylbutanoic acid CAS Name: 2-(3-chloro-4-fluorophenyl)sulfonylbutanoic acid IUPAC Name: 2-(3-chloro-4-fluorophenyl)sulfonylbutanoic acid Traditional Name: 2-(3-chloro-4-fluoro-phenyl)sulfonylbutyric acid Formula: C10H10ClFO4S MolecularWeight: 280.700403

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H10ClFO4S/c1-2-9(10(13)14)17(15,16)6-3-4-8(12)7(11)5-6/h3-5,9H,2H2,1H3,(H,13,14)