1-[3,4-bis(chloranyl)-2-methoxy-phenyl]sulfonyl-4-ethyl-piperazin-4-ium

Systemtic Name: 1-[3,4-bis(chloranyl)-2-methoxy-phenyl]sulfonyl-4-ethyl-piperazin-4-ium Openeye Name: 1-(3,4-dichloro-2-methoxy-phenyl)sulfonyl-4-ethyl-piperazin-4-ium CAS Name: 1-(3,4-dichloro-2-methoxyphenyl)sulfonyl-4-ethylpiperazin-4-ium IUPAC Name: 1-(3,4-dichloro-2-methoxyphenyl)sulfonyl-4-ethylpiperazin-4-ium Traditional Name: 1-(3,4-dichloro-2-methoxy-phenyl)sulfonyl-4-ethyl-piperazin-4-ium Formula: C13H19Cl2N2O3S+ MolecularWeight: 354.27256

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18Cl2N2O3S/c1-3-16-6-8-17(9-7-16)21(18,19)11-5-4-10(14)12(15)13(11)20-2/h4-5H,3,6-9H2,1-2H3/p+1