4-[2-(4-chlorophenyl)sulfonylethyl]-N,N-diethyl-piperazin-4-ium-1-sulfonamide

Systemtic Name: 4-[2-(4-chlorophenyl)sulfonylethyl]-N,N-diethyl-piperazin-4-ium-1-sulfonamide Openeye Name: 4-[2-(4-chlorophenyl)sulfonylethyl]-N,N-diethyl-piperazin-4-ium-1-sulfonamide CAS Name: 4-[2-(4-chlorophenyl)sulfonylethyl]-N,N-diethyl-1-piperazin-4-iumsulfonamide IUPAC Name: 4-[2-(4-chlorophenyl)sulfonylethyl]-N,N-diethylpiperazin-4-ium-1-sulfonamide Traditional Name: 4-[2-(4-chlorophenyl)sulfonylethyl]-N,N-diethyl-piperazin-4-ium-1-sulfonamide Formula: C16H27ClN3O4S2+ MolecularWeight: 424.98628

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)N1CC[NH+](CC1)CCS(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCN(CC)S(=O)(=O)N1CC[NH+](CC1)CCS(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H26ClN3O4S2/c1-3-19(4-2)26(23,24)20-11-9-18(10-12-20)13-14-25(21,22)16-7-5-15(17)6-8-16/h5-8H,3-4,9-14H2,1-2H3/p+1