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(4-ethylphenyl) 1-[3-(trifluoromethyl)phenyl]sulfonylpiperidine-4-carboxylate

(4-ethylphenyl) 1-[3-(trifluoromethyl)phenyl]sulfonylpiperidine-4-carboxylate

Systemtic Name:(4-ethylphenyl) 1-[3-(trifluoromethyl)phenyl]sulfonylpiperidine-4-carboxylate
Openeye Name:(4-ethylphenyl) 1-[3-(trifluoromethyl)phenyl]sulfonylpiperidine-4-carboxylate
CAS Name:1-[3-(trifluoromethyl)phenyl]sulfonyl-4-piperidinecarboxylic acid (4-ethylphenyl) ester
IUPAC Name:(4-ethylphenyl) 1-[3-(trifluoromethyl)phenyl]sulfonylpiperidine-4-carboxylate
Traditional Name:1-[3-(trifluoromethyl)phenyl]sulfonylisonipecotic acid (4-ethylphenyl) ester
Formula: C21H22F3NO4S
MolecularWeight: 441.46389
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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F


Isomeric SMILES

CCC1=CC=C(C=C1)OC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F


InChI

InChI=1S/C21H22F3NO4S/c1-2-15-6-8-18(9-7-15)29-20(26)16-10-12-25(13-11-16)30(27,28)19-5-3-4-17(14-19)21(22,23)24/h3-9,14,16H,2,10-13H2,1H3


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