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4-[4-[4-(trifluoromethyloxy)phenoxy]piperidin-1-yl]sulfonylpiperidine-4-carboxylic acid

4-[4-[4-(trifluoromethyloxy)phenoxy]piperidin-1-yl]sulfonylpiperidine-4-carboxylic acid

Systemtic Name:4-[4-[4-(trifluoromethyloxy)phenoxy]piperidin-1-yl]sulfonylpiperidine-4-carboxylic acid
Openeye Name:4-[[4-[4-(trifluoromethoxy)phenoxy]-1-piperidyl]sulfonyl]piperidine-4-carboxylic acid
CAS Name:4-[[4-[4-(trifluoromethoxy)phenoxy]-1-piperidinyl]sulfonyl]-4-piperidinecarboxylic acid
IUPAC Name:4-[4-[4-(trifluoromethoxy)phenoxy]piperidin-1-yl]sulfonylpiperidine-4-carboxylic acid
Traditional Name:4-[4-[4-(trifluoromethoxy)phenoxy]piperidino]sulfonylisonipecotic acid
Formula: C18H23F3N2O6S
MolecularWeight: 452.44523
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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1OC2=CC=C(C=C2)OC(F)(F)F)S(=O)(=O)C3(CCNCC3)C(=O)O


Isomeric SMILES

C1CN(CCC1OC2=CC=C(C=C2)OC(F)(F)F)S(=O)(=O)C3(CCNCC3)C(=O)O


InChI

InChI=1S/C18H23F3N2O6S/c19-18(20,21)29-15-3-1-13(2-4-15)28-14-5-11-23(12-6-14)30(26,27)17(16(24)25)7-9-22-10-8-17/h1-4,14,22H,5-12H2,(H,24,25)


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