N-[2-(4-ethylpiperazin-4-ium-1-yl)carbonylphenyl]-N,4-dimethyl-benzenesulfonamide

Systemtic Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)carbonylphenyl]-N,4-dimethyl-benzenesulfonamide Openeye Name: N-[2-(4-ethylpiperazin-4-ium-1-carbonyl)phenyl]-N,4-dimethyl-benzenesulfonamide CAS Name: N-[2-[(4-ethyl-1-piperazin-4-iumyl)-oxomethyl]phenyl]-N,4-dimethylbenzenesulfonamide IUPAC Name: N-[2-(4-ethylpiperazin-4-ium-1-carbonyl)phenyl]-N,4-dimethylbenzenesulfonamide Traditional Name: N-[2-(4-ethylpiperazin-4-ium-1-carbonyl)phenyl]-N,4-dimethyl-benzenesulfonamide Formula: C21H28N3O3S+ MolecularWeight: 402.53032

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)C2=CC=CC=C2N(C)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)C2=CC=CC=C2N(C)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C21H27N3O3S/c1-4-23-13-15-24(16-14-23)21(25)19-7-5-6-8-20(19)22(3)28(26,27)18-11-9-17(2)10-12-18/h5-12H,4,13-16H2,1-3H3/p+1