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

Systemtic Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2,4,6-trimethyl-benzenesulfonamide Openeye Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2,4,6-trimethyl-benzenesulfonamide CAS Name: N-[2-(4-ethyl-1-piperazin-4-iumyl)phenyl]-2,4,6-trimethylbenzenesulfonamide IUPAC Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2,4,6-trimethylbenzenesulfonamide Traditional Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2,4,6-trimethyl-benzenesulfonamide Formula: C21H30N3O2S+ MolecularWeight: 388.5468

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H29N3O2S/c1-5-23-10-12-24(13-11-23)20-9-7-6-8-19(20)22-27(25,26)21-17(3)14-16(2)15-18(21)4/h6-9,14-15,22H,5,10-13H2,1-4H3/p+1