N-[[(3S)-1-(1,3-benzodioxol-5-yl)-5-oxidanylidene-pyrrolidin-3-yl]methyl]-2,4-dimethyl-benzenesulfonamide

Systemtic Name: N-[[(3S)-1-(1,3-benzodioxol-5-yl)-5-oxidanylidene-pyrrolidin-3-yl]methyl]-2,4-dimethyl-benzenesulfonamide Openeye Name: N-[[(3S)-1-(1,3-benzodioxol-5-yl)-5-oxo-pyrrolidin-3-yl]methyl]-2,4-dimethyl-benzenesulfonamide CAS Name: N-[[(3S)-1-(1,3-benzodioxol-5-yl)-5-oxo-3-pyrrolidinyl]methyl]-2,4-dimethylbenzenesulfonamide IUPAC Name: N-[[(3S)-1-(1,3-benzodioxol-5-yl)-5-oxopyrrolidin-3-yl]methyl]-2,4-dimethylbenzenesulfonamide Traditional Name: N-[[(3S)-1-(1,3-benzodioxol-5-yl)-5-keto-pyrrolidin-3-yl]methyl]-2,4-dimethyl-benzenesulfonamide Formula: C20H22N2O5S MolecularWeight: 402.46408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)NCC2CC(=O)N(C2)C3=CC4=C(C=C3)OCO4)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)NC[C@H]2CC(=O)N(C2)C3=CC4=C(C=C3)OCO4)C

InChI

InChI=1S/C20H22N2O5S/c1-13-3-6-19(14(2)7-13)28(24,25)21-10-15-8-20(23)22(11-15)16-4-5-17-18(9-16)27-12-26-17/h3-7,9,15,21H,8,10-12H2,1-2H3/t15-/m1/s1