5-[(2S,6S)-2,6-dimethylpiperidin-1-yl]sulfonyl-2-fluoranyl-benzoate

Systemtic Name: 5-[(2S,6S)-2,6-dimethylpiperidin-1-yl]sulfonyl-2-fluoranyl-benzoate Openeye Name: 5-[[(2S,6S)-2,6-dimethyl-1-piperidyl]sulfonyl]-2-fluoro-benzoate CAS Name: 5-[[(2S,6S)-2,6-dimethyl-1-piperidinyl]sulfonyl]-2-fluorobenzoate IUPAC Name: 5-[(2S,6S)-2,6-dimethylpiperidin-1-yl]sulfonyl-2-fluorobenzoate Traditional Name: 5-[(2S,6S)-2,6-dimethylpiperidino]sulfonyl-2-fluoro-benzoate Formula: C14H17FNO4S- MolecularWeight: 314.352483

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1S(=O)(=O)C2=CC(=C(C=C2)F)C(=O)[O-])C

Isomeric SMILES

C[C@H]1CCC[C@@H](N1S(=O)(=O)C2=CC(=C(C=C2)F)C(=O)[O-])C

InChI

InChI=1S/C14H18FNO4S/c1-9-4-3-5-10(2)16(9)21(19,20)11-6-7-13(15)12(8-11)14(17)18/h6-10H,3-5H2,1-2H3,(H,17,18)/p-1/t9-,10-/m0/s1