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

Systemtic Name: 1-[(3,4-dichlorophenyl)methyl]-4-(phenylsulfonyl)piperazin-1-ium Openeye Name: 1-(benzenesulfonyl)-4-[(3,4-dichlorophenyl)methyl]piperazin-4-ium CAS Name: 1-(benzenesulfonyl)-4-[(3,4-dichlorophenyl)methyl]piperazin-4-ium IUPAC Name: 1-(benzenesulfonyl)-4-[(3,4-dichlorophenyl)methyl]piperazin-4-ium Traditional Name: 1-besyl-4-(3,4-dichlorobenzyl)piperazin-4-ium Formula: C17H19Cl2N2O2S+ MolecularWeight: 386.31596

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC(=C(C=C2)Cl)Cl)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC(=C(C=C2)Cl)Cl)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C17H18Cl2N2O2S/c18-16-7-6-14(12-17(16)19)13-20-8-10-21(11-9-20)24(22,23)15-4-2-1-3-5-15/h1-7,12H,8-11,13H2/p+1