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

Systemtic Name: 5-(3,5-dimethylpiperidin-1-yl)sulfonyl-2-methoxy-3-(trifluoromethyl)benzoic acid Openeye Name: 5-[(3,5-dimethyl-1-piperidyl)sulfonyl]-2-methoxy-3-(trifluoromethyl)benzoic acid CAS Name: 5-[(3,5-dimethyl-1-piperidinyl)sulfonyl]-2-methoxy-3-(trifluoromethyl)benzoic acid IUPAC Name: 5-(3,5-dimethylpiperidin-1-yl)sulfonyl-2-methoxy-3-(trifluoromethyl)benzoic acid Traditional Name: 5-(3,5-dimethylpiperidino)sulfonyl-2-methoxy-3-(trifluoromethyl)benzoic acid Formula: C16H20F3NO5S MolecularWeight: 395.39391

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20F3NO5S/c1-9-4-10(2)8-20(7-9)26(23,24)11-5-12(15(21)22)14(25-3)13(6-11)16(17,18)19/h5-6,9-10H,4,7-8H2,1-3H3,(H,21,22)