1-(3-chlorophenyl)-4-(4-methylphenyl)sulfonyl-piperazin-1-ium

Systemtic Name: 1-(3-chlorophenyl)-4-(4-methylphenyl)sulfonyl-piperazin-1-ium Openeye Name: 1-(3-chlorophenyl)-4-(p-tolylsulfonyl)piperazin-1-ium CAS Name: 1-(3-chlorophenyl)-4-(4-methylphenyl)sulfonylpiperazin-1-ium IUPAC Name: 1-(3-chlorophenyl)-4-(4-methylphenyl)sulfonylpiperazin-1-ium Traditional Name: 1-(3-chlorophenyl)-4-tosyl-piperazin-1-ium Formula: C17H20ClN2O2S+ MolecularWeight: 351.8709

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)C3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C17H19ClN2O2S/c1-14-5-7-17(8-6-14)23(21,22)20-11-9-19(10-12-20)16-4-2-3-15(18)13-16/h2-8,13H,9-12H2,1H3/p+1