N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2,5-dimethoxy-benzenesulfonamide

Systemtic Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2,5-dimethoxy-benzenesulfonamide Openeye Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2,5-dimethoxy-benzenesulfonamide CAS Name: N-[2-(4-ethyl-1-piperazin-4-iumyl)phenyl]-2,5-dimethoxybenzenesulfonamide IUPAC Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2,5-dimethoxybenzenesulfonamide Traditional Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2,5-dimethoxy-benzenesulfonamide Formula: C20H28N3O4S+ MolecularWeight: 406.51902

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC=CC=C2NS(=O)(=O)C3=C(C=CC(=C3)OC)OC

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC=CC=C2NS(=O)(=O)C3=C(C=CC(=C3)OC)OC

InChI

InChI=1S/C20H27N3O4S/c1-4-22-11-13-23(14-12-22)18-8-6-5-7-17(18)21-28(24,25)20-15-16(26-2)9-10-19(20)27-3/h5-10,15,21H,4,11-14H2,1-3H3/p+1