1-[[2,6-bis(chloranyl)phenyl]methyl]-4-butylsulfonyl-piperazin-1-ium

Systemtic Name: 1-[[2,6-bis(chloranyl)phenyl]methyl]-4-butylsulfonyl-piperazin-1-ium Openeye Name: 1-butylsulfonyl-4-[(2,6-dichlorophenyl)methyl]piperazin-4-ium CAS Name: 1-butylsulfonyl-4-[(2,6-dichlorophenyl)methyl]piperazin-4-ium IUPAC Name: 1-butylsulfonyl-4-[(2,6-dichlorophenyl)methyl]piperazin-4-ium Traditional Name: 1-butylsulfonyl-4-(2,6-dichlorobenzyl)piperazin-4-ium Formula: C15H23Cl2N2O2S+ MolecularWeight: 366.32632

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)N1CC[NH+](CC1)CC2=C(C=CC=C2Cl)Cl

Isomeric SMILES

CCCCS(=O)(=O)N1CC[NH+](CC1)CC2=C(C=CC=C2Cl)Cl

InChI

InChI=1S/C15H22Cl2N2O2S/c1-2-3-11-22(20,21)19-9-7-18(8-10-19)12-13-14(16)5-4-6-15(13)17/h4-6H,2-3,7-12H2,1H3/p+1