1-[3-(4-chlorophenyl)sulfonylphenyl]sulfonyl-4-methyl-piperazin-4-ium

Systemtic Name: 1-[3-(4-chlorophenyl)sulfonylphenyl]sulfonyl-4-methyl-piperazin-4-ium Openeye Name: 1-[3-(4-chlorophenyl)sulfonylphenyl]sulfonyl-4-methyl-piperazin-4-ium CAS Name: 1-[3-(4-chlorophenyl)sulfonylphenyl]sulfonyl-4-methylpiperazin-4-ium IUPAC Name: 1-[3-(4-chlorophenyl)sulfonylphenyl]sulfonyl-4-methylpiperazin-4-ium Traditional Name: 1-[3-(4-chlorophenyl)sulfonylphenyl]sulfonyl-4-methyl-piperazin-4-ium Formula: C17H20ClN2O4S2+ MolecularWeight: 415.9347

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19ClN2O4S2/c1-19-9-11-20(12-10-19)26(23,24)17-4-2-3-16(13-17)25(21,22)15-7-5-14(18)6-8-15/h2-8,13H,9-12H2,1H3/p+1