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

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

Isomeric SMILES

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

InChI

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