3-[[4-chloranyl-3-(trifluoromethyl)phenyl]sulfonylamino]butanoic acid

Systemtic Name: 3-[[4-chloranyl-3-(trifluoromethyl)phenyl]sulfonylamino]butanoic acid Openeye Name: 3-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]butanoic acid CAS Name: 3-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]butanoic acid IUPAC Name: 3-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]butanoic acid Traditional Name: 3-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]butyric acid Formula: C11H11ClF3NO4S MolecularWeight: 345.72255

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11ClF3NO4S/c1-6(4-10(17)18)16-21(19,20)7-2-3-9(12)8(5-7)11(13,14)15/h2-3,5-6,16H,4H2,1H3,(H,17,18)