N1-[3-chloranyl-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-N4,N4-dimethyl-benzene-1,4-disulfonamide

Systemtic Name: N1-[3-chloranyl-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-N4,N4-dimethyl-benzene-1,4-disulfonamide Openeye Name: N1-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-N4,N4-dimethyl-benzene-1,4-disulfonamide CAS Name: N1-[3-chloro-4-(2-oxo-1-pyrrolidinyl)phenyl]-N4,N4-dimethylbenzene-1,4-disulfonamide IUPAC Name: 1-N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-4-N,4-N-dimethylbenzene-1,4-disulfonamide Traditional Name: N-[3-chloro-4-(2-ketopyrrolidino)phenyl]-N',N'-dimethyl-benzene-1,4-disulfonamide Formula: C18H20ClN3O5S2 MolecularWeight: 457.9515

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2)N3CCCC3=O)Cl

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2)N3CCCC3=O)Cl

InChI

InChI=1S/C18H20ClN3O5S2/c1-21(2)29(26,27)15-8-6-14(7-9-15)28(24,25)20-13-5-10-17(16(19)12-13)22-11-3-4-18(22)23/h5-10,12,20H,3-4,11H2,1-2H3