N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2,3,5,6-tetramethyl-benzenesulfonamide

Systemtic Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2,3,5,6-tetramethyl-benzenesulfonamide Openeye Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2,3,5,6-tetramethyl-benzenesulfonamide CAS Name: N-[2-(4-ethyl-1-piperazin-4-iumyl)phenyl]-2,3,5,6-tetramethylbenzenesulfonamide IUPAC Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2,3,5,6-tetramethylbenzenesulfonamide Traditional Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2,3,5,6-tetramethyl-benzenesulfonamide Formula: C22H32N3O2S+ MolecularWeight: 402.57338

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC=CC=C2NS(=O)(=O)C3=C(C(=CC(=C3C)C)C)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC=CC=C2NS(=O)(=O)C3=C(C(=CC(=C3C)C)C)C

InChI

InChI=1S/C22H31N3O2S/c1-6-24-11-13-25(14-12-24)21-10-8-7-9-20(21)23-28(26,27)22-18(4)16(2)15-17(3)19(22)5/h7-10,15,23H,6,11-14H2,1-5H3/p+1