N-[[(3S)-1-(4-ethoxyphenyl)-5-oxidanylidene-pyrrolidin-3-yl]methyl]-2,4,6-trimethyl-benzenesulfonamide

Systemtic Name: N-[[(3S)-1-(4-ethoxyphenyl)-5-oxidanylidene-pyrrolidin-3-yl]methyl]-2,4,6-trimethyl-benzenesulfonamide Openeye Name: N-[[(3S)-1-(4-ethoxyphenyl)-5-oxo-pyrrolidin-3-yl]methyl]-2,4,6-trimethyl-benzenesulfonamide CAS Name: N-[[(3S)-1-(4-ethoxyphenyl)-5-oxo-3-pyrrolidinyl]methyl]-2,4,6-trimethylbenzenesulfonamide IUPAC Name: N-[[(3S)-1-(4-ethoxyphenyl)-5-oxopyrrolidin-3-yl]methyl]-2,4,6-trimethylbenzenesulfonamide Traditional Name: N-[[(3S)-5-keto-1-p-phenetyl-pyrrolidin-3-yl]methyl]-2,4,6-trimethyl-benzenesulfonamide Formula: C22H28N2O4S MolecularWeight: 416.53372

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28N2O4S/c1-5-28-20-8-6-19(7-9-20)24-14-18(12-21(24)25)13-23-29(26,27)22-16(3)10-15(2)11-17(22)4/h6-11,18,23H,5,12-14H2,1-4H3/t18-/m1/s1