N-[2-[4-(2-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]ethyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[2-[4-(2-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]ethyl]-4-methyl-benzenesulfonamide Openeye Name: N-[2-[4-(2-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]ethyl]-4-methyl-benzenesulfonamide CAS Name: N-[2-[4-(2-chlorophenyl)sulfonyl-1-piperazin-1-iumyl]ethyl]-4-methylbenzenesulfonamide IUPAC Name: N-[2-[4-(2-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]ethyl]-4-methylbenzenesulfonamide Traditional Name: N-[2-[4-(2-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]ethyl]-4-methyl-benzenesulfonamide Formula: C19H25ClN3O4S2+ MolecularWeight: 459.0025

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCC[NH+]2CCN(CC2)S(=O)(=O)C3=CC=CC=C3Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCC[NH+]2CCN(CC2)S(=O)(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C19H24ClN3O4S2/c1-16-6-8-17(9-7-16)28(24,25)21-10-11-22-12-14-23(15-13-22)29(26,27)19-5-3-2-4-18(19)20/h2-9,21H,10-15H2,1H3/p+1