N3-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]benzene-1,3-disulfonamide

Systemtic Name: N3-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]benzene-1,3-disulfonamide Openeye Name: N3-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]benzene-1,3-disulfonamide CAS Name: N3-[[4-(2-oxo-1-pyrrolidinyl)phenyl]methyl]benzene-1,3-disulfonamide IUPAC Name: 3-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]benzene-1,3-disulfonamide Traditional Name: N'-[4-(2-ketopyrrolidino)benzyl]benzene-1,3-disulfonamide Formula: C17H19N3O5S2 MolecularWeight: 409.47986

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=C(C=C2)CNS(=O)(=O)C3=CC=CC(=C3)S(=O)(=O)N

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=C(C=C2)CNS(=O)(=O)C3=CC=CC(=C3)S(=O)(=O)N

InChI

InChI=1S/C17H19N3O5S2/c18-26(22,23)15-3-1-4-16(11-15)27(24,25)19-12-13-6-8-14(9-7-13)20-10-2-5-17(20)21/h1,3-4,6-9,11,19H,2,5,10,12H2,(H2,18,22,23)