N-[[(3S)-1-(4-ethoxyphenyl)-5-oxidanylidene-pyrrolidin-3-yl]methyl]-2-(trifluoromethyl)benzenesulfonamide

Systemtic Name: N-[[(3S)-1-(4-ethoxyphenyl)-5-oxidanylidene-pyrrolidin-3-yl]methyl]-2-(trifluoromethyl)benzenesulfonamide Openeye Name: N-[[(3S)-1-(4-ethoxyphenyl)-5-oxo-pyrrolidin-3-yl]methyl]-2-(trifluoromethyl)benzenesulfonamide CAS Name: N-[[(3S)-1-(4-ethoxyphenyl)-5-oxo-3-pyrrolidinyl]methyl]-2-(trifluoromethyl)benzenesulfonamide IUPAC Name: N-[[(3S)-1-(4-ethoxyphenyl)-5-oxopyrrolidin-3-yl]methyl]-2-(trifluoromethyl)benzenesulfonamide Traditional Name: N-[[(3S)-5-keto-1-p-phenetyl-pyrrolidin-3-yl]methyl]-2-(trifluoromethyl)benzenesulfonamide Formula: C20H21F3N2O4S MolecularWeight: 442.45195

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2CC(CC2=O)CNS(=O)(=O)C3=CC=CC=C3C(F)(F)F

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C[C@H](CC2=O)CNS(=O)(=O)C3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C20H21F3N2O4S/c1-2-29-16-9-7-15(8-10-16)25-13-14(11-19(25)26)12-24-30(27,28)18-6-4-3-5-17(18)20(21,22)23/h3-10,14,24H,2,11-13H2,1H3/t14-/m1/s1