4-chloranyl-N-[4-(4-ethylpiperazin-4-ium-1-yl)carbonylphenyl]-N-methyl-benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[4-(4-ethylpiperazin-4-ium-1-yl)carbonylphenyl]-N-methyl-benzenesulfonamide Openeye Name: 4-chloro-N-[4-(4-ethylpiperazin-4-ium-1-carbonyl)phenyl]-N-methyl-benzenesulfonamide CAS Name: 4-chloro-N-[4-[(4-ethyl-1-piperazin-4-iumyl)-oxomethyl]phenyl]-N-methylbenzenesulfonamide IUPAC Name: 4-chloro-N-[4-(4-ethylpiperazin-4-ium-1-carbonyl)phenyl]-N-methylbenzenesulfonamide Traditional Name: 4-chloro-N-[4-(4-ethylpiperazin-4-ium-1-carbonyl)phenyl]-N-methyl-benzenesulfonamide Formula: C20H25ClN3O3S+ MolecularWeight: 422.9488

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24ClN3O3S/c1-3-23-12-14-24(15-13-23)20(25)16-4-8-18(9-5-16)22(2)28(26,27)19-10-6-17(21)7-11-19/h4-11H,3,12-15H2,1-2H3/p+1