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

Systemtic Name: 1-[3-(3,4-dichlorophenyl)sulfonylphenyl]sulfonyl-4-methyl-piperazin-4-ium Openeye Name: 1-[3-(3,4-dichlorophenyl)sulfonylphenyl]sulfonyl-4-methyl-piperazin-4-ium CAS Name: 1-[3-(3,4-dichlorophenyl)sulfonylphenyl]sulfonyl-4-methylpiperazin-4-ium IUPAC Name: 1-[3-(3,4-dichlorophenyl)sulfonylphenyl]sulfonyl-4-methylpiperazin-4-ium Traditional Name: 1-[3-(3,4-dichlorophenyl)sulfonylphenyl]sulfonyl-4-methyl-piperazin-4-ium Formula: C17H19Cl2N2O4S2+ MolecularWeight: 450.37976

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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)Cl

Isomeric SMILES

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

InChI

InChI=1S/C17H18Cl2N2O4S2/c1-20-7-9-21(10-8-20)27(24,25)15-4-2-3-13(11-15)26(22,23)14-5-6-16(18)17(19)12-14/h2-6,11-12H,7-10H2,1H3/p+1