5-(3,5-dimethylpiperidin-1-yl)sulfonyl-2-fluoranyl-3-(trifluoromethyl)benzoic acid

Systemtic Name: 5-(3,5-dimethylpiperidin-1-yl)sulfonyl-2-fluoranyl-3-(trifluoromethyl)benzoic acid Openeye Name: 5-[(3,5-dimethyl-1-piperidyl)sulfonyl]-2-fluoro-3-(trifluoromethyl)benzoic acid CAS Name: 5-[(3,5-dimethyl-1-piperidinyl)sulfonyl]-2-fluoro-3-(trifluoromethyl)benzoic acid IUPAC Name: 5-(3,5-dimethylpiperidin-1-yl)sulfonyl-2-fluoro-3-(trifluoromethyl)benzoic acid Traditional Name: 5-(3,5-dimethylpiperidino)sulfonyl-2-fluoro-3-(trifluoromethyl)benzoic acid Formula: C15H17F4NO4S MolecularWeight: 383.358393

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC(=C(C(=C2)C(=O)O)F)C(F)(F)F)C

Isomeric SMILES

CC1CC(CN(C1)S(=O)(=O)C2=CC(=C(C(=C2)C(=O)O)F)C(F)(F)F)C

InChI

InChI=1S/C15H17F4NO4S/c1-8-3-9(2)7-20(6-8)25(23,24)10-4-11(14(21)22)13(16)12(5-10)15(17,18)19/h4-5,8-9H,3,6-7H2,1-2H3,(H,21,22)