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

Systemtic Name: 1-[(3,4-dichlorophenyl)methyl]-4-ethylsulfonyl-piperazin-1-ium Openeye Name: 1-[(3,4-dichlorophenyl)methyl]-4-ethylsulfonyl-piperazin-1-ium CAS Name: 1-[(3,4-dichlorophenyl)methyl]-4-ethylsulfonylpiperazin-1-ium IUPAC Name: 1-[(3,4-dichlorophenyl)methyl]-4-ethylsulfonylpiperazin-1-ium Traditional Name: 1-(3,4-dichlorobenzyl)-4-esyl-piperazin-1-ium Formula: C13H19Cl2N2O2S+ MolecularWeight: 338.27316

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CC[NH+](CC1)CC2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

CCS(=O)(=O)N1CC[NH+](CC1)CC2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C13H18Cl2N2O2S/c1-2-20(18,19)17-7-5-16(6-8-17)10-11-3-4-12(14)13(15)9-11/h3-4,9H,2,5-8,10H2,1H3/p+1