N-[[2-[(2-oxidanylidenepyrrolidin-1-yl)methyl]phenyl]methyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide

Systemtic Name: N-[[2-[(2-oxidanylidenepyrrolidin-1-yl)methyl]phenyl]methyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Openeye Name: N-[[2-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide CAS Name: N-[[2-[(2-oxo-1-pyrrolidinyl)methyl]phenyl]methyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide IUPAC Name: N-[[2-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Traditional Name: N-[2-[(2-ketopyrrolidino)methyl]benzyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide Formula: C20H22N2O5S MolecularWeight: 402.46408

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)CC2=CC=CC=C2CNS(=O)(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C1CC(=O)N(C1)CC2=CC=CC=C2CNS(=O)(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C20H22N2O5S/c23-20-6-3-9-22(20)14-16-5-2-1-4-15(16)13-21-28(24,25)17-7-8-18-19(12-17)27-11-10-26-18/h1-2,4-5,7-8,12,21H,3,6,9-11,13-14H2