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

Systemtic Name: 1-[2,5-bis(chloranyl)-4-ethoxy-phenyl]sulfonyl-4-methyl-piperazin-4-ium Openeye Name: 1-(2,5-dichloro-4-ethoxy-phenyl)sulfonyl-4-methyl-piperazin-4-ium CAS Name: 1-(2,5-dichloro-4-ethoxyphenyl)sulfonyl-4-methylpiperazin-4-ium IUPAC Name: 1-(2,5-dichloro-4-ethoxyphenyl)sulfonyl-4-methylpiperazin-4-ium Traditional Name: 1-(2,5-dichloro-4-ethoxy-phenyl)sulfonyl-4-methyl-piperazin-4-ium Formula: C13H19Cl2N2O3S+ MolecularWeight: 354.27256

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1Cl)S(=O)(=O)N2CC[NH+](CC2)C)Cl

Isomeric SMILES

CCOC1=CC(=C(C=C1Cl)S(=O)(=O)N2CC[NH+](CC2)C)Cl

InChI

InChI=1S/C13H18Cl2N2O3S/c1-3-20-12-8-11(15)13(9-10(12)14)21(18,19)17-6-4-16(2)5-7-17/h8-9H,3-7H2,1-2H3/p+1