N,N-dimethyl-4-[1-(2-morpholin-4-ium-4-ylethyl)-4,5-bis(oxidanylidene)-2-phenyl-pyrrolidin-3-yl]carbonyl-benzenesulfonamide

Systemtic Name: N,N-dimethyl-4-[1-(2-morpholin-4-ium-4-ylethyl)-4,5-bis(oxidanylidene)-2-phenyl-pyrrolidin-3-yl]carbonyl-benzenesulfonamide Openeye Name: N,N-dimethyl-4-[1-(2-morpholin-4-ium-4-ylethyl)-4,5-dioxo-2-phenyl-pyrrolidine-3-carbonyl]benzenesulfonamide CAS Name: N,N-dimethyl-4-[[1-[2-(4-morpholin-4-iumyl)ethyl]-4,5-dioxo-2-phenyl-3-pyrrolidinyl]-oxomethyl]benzenesulfonamide IUPAC Name: N,N-dimethyl-4-[1-(2-morpholin-4-ium-4-ylethyl)-4,5-dioxo-2-phenylpyrrolidine-3-carbonyl]benzenesulfonamide Traditional Name: 4-[4,5-diketo-1-(2-morpholin-4-ium-4-ylethyl)-2-phenyl-pyrrolidine-3-carbonyl]-N,N-dimethyl-benzenesulfonamide Formula: C25H30N3O6S+ MolecularWeight: 500.5872

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)C2C(N(C(=O)C2=O)CC[NH+]3CCOCC3)C4=CC=CC=C4

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)C2C(N(C(=O)C2=O)CC[NH+]3CCOCC3)C4=CC=CC=C4

InChI

InChI=1S/C25H29N3O6S/c1-26(2)35(32,33)20-10-8-19(9-11-20)23(29)21-22(18-6-4-3-5-7-18)28(25(31)24(21)30)13-12-27-14-16-34-17-15-27/h3-11,21-22H,12-17H2,1-2H3/p+1