1-[2,4-bis(chloranyl)-5-methyl-phenyl]sulfonyl-4-ethyl-piperazin-4-ium

Systemtic Name: 1-[2,4-bis(chloranyl)-5-methyl-phenyl]sulfonyl-4-ethyl-piperazin-4-ium Openeye Name: 1-(2,4-dichloro-5-methyl-phenyl)sulfonyl-4-ethyl-piperazin-4-ium CAS Name: 1-(2,4-dichloro-5-methylphenyl)sulfonyl-4-ethylpiperazin-4-ium IUPAC Name: 1-(2,4-dichloro-5-methylphenyl)sulfonyl-4-ethylpiperazin-4-ium Traditional Name: 1-(2,4-dichloro-5-methyl-phenyl)sulfonyl-4-ethyl-piperazin-4-ium Formula: C13H19Cl2N2O2S+ MolecularWeight: 338.27316

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18Cl2N2O2S/c1-3-16-4-6-17(7-5-16)20(18,19)13-8-10(2)11(14)9-12(13)15/h8-9H,3-7H2,1-2H3/p+1