ethyl 4-[4-[[3-(trifluoromethyl)phenyl]carbamoyl]piperidin-1-yl]sulfonylbenzoate

Systemtic Name: ethyl 4-[4-[[3-(trifluoromethyl)phenyl]carbamoyl]piperidin-1-yl]sulfonylbenzoate Openeye Name: ethyl 4-[[4-[[3-(trifluoromethyl)phenyl]carbamoyl]-1-piperidyl]sulfonyl]benzoate CAS Name: 4-[[4-[oxo-[3-(trifluoromethyl)anilino]methyl]-1-piperidinyl]sulfonyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-[[3-(trifluoromethyl)phenyl]carbamoyl]piperidin-1-yl]sulfonylbenzoate Traditional Name: 4-[4-[[3-(trifluoromethyl)phenyl]carbamoyl]piperidino]sulfonylbenzoic acid ethyl ester Formula: C22H23F3N2O5S MolecularWeight: 484.48863

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C22H23F3N2O5S/c1-2-32-21(29)16-6-8-19(9-7-16)33(30,31)27-12-10-15(11-13-27)20(28)26-18-5-3-4-17(14-18)22(23,24)25/h3-9,14-15H,2,10-13H2,1H3,(H,26,28)