3-(3,5-dimethylpiperidin-1-yl)sulfonyl-2,6-bis(fluoranyl)benzoic acid

Systemtic Name: 3-(3,5-dimethylpiperidin-1-yl)sulfonyl-2,6-bis(fluoranyl)benzoic acid Openeye Name: 3-[(3,5-dimethyl-1-piperidyl)sulfonyl]-2,6-difluoro-benzoic acid CAS Name: 3-[(3,5-dimethyl-1-piperidinyl)sulfonyl]-2,6-difluorobenzoic acid IUPAC Name: 3-(3,5-dimethylpiperidin-1-yl)sulfonyl-2,6-difluorobenzoic acid Traditional Name: 3-(3,5-dimethylpiperidino)sulfonyl-2,6-difluoro-benzoic acid Formula: C14H17F2NO4S MolecularWeight: 333.350886

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17F2NO4S/c1-8-5-9(2)7-17(6-8)22(20,21)11-4-3-10(15)12(13(11)16)14(18)19/h3-4,8-9H,5-7H2,1-2H3,(H,18,19)