1-(4-ethoxyphenyl)sulfonyl-N-[2,3,4-tris(fluoranyl)phenyl]piperidine-4-carboxamide

Systemtic Name: 1-(4-ethoxyphenyl)sulfonyl-N-[2,3,4-tris(fluoranyl)phenyl]piperidine-4-carboxamide Openeye Name: 1-(4-ethoxyphenyl)sulfonyl-N-(2,3,4-trifluorophenyl)piperidine-4-carboxamide CAS Name: 1-(4-ethoxyphenyl)sulfonyl-N-(2,3,4-trifluorophenyl)-4-piperidinecarboxamide IUPAC Name: 1-(4-ethoxyphenyl)sulfonyl-N-(2,3,4-trifluorophenyl)piperidine-4-carboxamide Traditional Name: 1-p-phenetylsulfonyl-N-(2,3,4-trifluorophenyl)isonipecotamide Formula: C20H21F3N2O4S MolecularWeight: 442.45195

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=C(C(=C(C=C3)F)F)F

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=C(C(=C(C=C3)F)F)F

InChI

InChI=1S/C20H21F3N2O4S/c1-2-29-14-3-5-15(6-4-14)30(27,28)25-11-9-13(10-12-25)20(26)24-17-8-7-16(21)18(22)19(17)23/h3-8,13H,2,9-12H2,1H3,(H,24,26)