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

Systemtic Name: N-[[(3S)-1-(1,3-benzodioxol-5-yl)-5-oxidanylidene-pyrrolidin-3-yl]methyl]-4-methoxy-3-methyl-benzenesulfonamide Openeye Name: N-[[(3S)-1-(1,3-benzodioxol-5-yl)-5-oxo-pyrrolidin-3-yl]methyl]-4-methoxy-3-methyl-benzenesulfonamide CAS Name: N-[[(3S)-1-(1,3-benzodioxol-5-yl)-5-oxo-3-pyrrolidinyl]methyl]-4-methoxy-3-methylbenzenesulfonamide IUPAC Name: N-[[(3S)-1-(1,3-benzodioxol-5-yl)-5-oxopyrrolidin-3-yl]methyl]-4-methoxy-3-methylbenzenesulfonamide Traditional Name: N-[[(3S)-1-(1,3-benzodioxol-5-yl)-5-keto-pyrrolidin-3-yl]methyl]-4-methoxy-3-methyl-benzenesulfonamide Formula: C20H22N2O6S MolecularWeight: 418.46348

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N2O6S/c1-13-7-16(4-6-17(13)26-2)29(24,25)21-10-14-8-20(23)22(11-14)15-3-5-18-19(9-15)28-12-27-18/h3-7,9,14,21H,8,10-12H2,1-2H3/t14-/m1/s1