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2-sulfonylethanoate; 4-[4-(trifluoromethyl)phenoxy]piperidine

2-sulfonylethanoate; 4-[4-(trifluoromethyl)phenoxy]piperidine

Systemtic Name:2-sulfonylethanoate; 4-[4-(trifluoromethyl)phenoxy]piperidine
Openeye Name:2-sulfonylacetate; 4-[4-(trifluoromethyl)phenoxy]piperidine
CAS Name:2-sulfonylacetate; 4-[4-(trifluoromethyl)phenoxy]piperidine
IUPAC Name:2-sulfonylacetate; 4-[4-(trifluoromethyl)phenoxy]piperidine
Traditional Name:2-sulfonylacetate; 4-[4-(trifluoromethyl)phenoxy]piperidine
Formula: C14H15F3NO5S-
MolecularWeight: 366.33281
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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1OC2=CC=C(C=C2)C(F)(F)F.C(=S(=O)=O)C(=O)[O-]


Isomeric SMILES

C1CNCCC1OC2=CC=C(C=C2)C(F)(F)F.C(=S(=O)=O)C(=O)[O-]


InChI

InChI=1S/C12H14F3NO.C2H2O4S/c13-12(14,15)9-1-3-10(4-2-9)17-11-5-7-16-8-6-11;3-2(4)1-7(5)6/h1-4,11,16H,5-8H2;1H,(H,3,4)/p-1


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