N-[2,5-bis(oxidanylidene)-1-phenyl-pyrrolidin-3-yl]-4-bromanyl-N-(2,2-dimethoxyethyl)benzenesulfonamide

Systemtic Name: N-[2,5-bis(oxidanylidene)-1-phenyl-pyrrolidin-3-yl]-4-bromanyl-N-(2,2-dimethoxyethyl)benzenesulfonamide Openeye Name: 4-bromo-N-(2,2-dimethoxyethyl)-N-(2,5-dioxo-1-phenyl-pyrrolidin-3-yl)benzenesulfonamide CAS Name: 4-bromo-N-(2,2-dimethoxyethyl)-N-(2,5-dioxo-1-phenyl-3-pyrrolidinyl)benzenesulfonamide IUPAC Name: 4-bromo-N-(2,2-dimethoxyethyl)-N-(2,5-dioxo-1-phenylpyrrolidin-3-yl)benzenesulfonamide Traditional Name: 4-bromo-N-(2,5-diketo-1-phenyl-pyrrolidin-3-yl)-N-(2,2-dimethoxyethyl)benzenesulfonamide Formula: C20H21BrN2O6S MolecularWeight: 497.35954

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Descriptors Computed from Structure

Canonical SMILES:

COC(CN(C1CC(=O)N(C1=O)C2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)Br)OC

Isomeric SMILES

COC(CN(C1CC(=O)N(C1=O)C2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)Br)OC

InChI

InChI=1S/C20H21BrN2O6S/c1-28-19(29-2)13-22(30(26,27)16-10-8-14(21)9-11-16)17-12-18(24)23(20(17)25)15-6-4-3-5-7-15/h3-11,17,19H,12-13H2,1-2H3