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

Systemtic Name: 1-[4-[[2,6-bis(chloranyl)phenyl]methyl]piperazin-4-ium-1-yl]propan-1-one Openeye Name: 1-[4-[(2,6-dichlorophenyl)methyl]piperazin-4-ium-1-yl]propan-1-one CAS Name: 1-[4-[(2,6-dichlorophenyl)methyl]-1-piperazin-4-iumyl]-1-propanone IUPAC Name: 1-[4-[(2,6-dichlorophenyl)methyl]piperazin-4-ium-1-yl]propan-1-one Traditional Name: 1-[4-(2,6-dichlorobenzyl)piperazin-4-ium-1-yl]propan-1-one Formula: C14H19Cl2N2O+ MolecularWeight: 302.21946

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18Cl2N2O/c1-2-14(19)18-8-6-17(7-9-18)10-11-12(15)4-3-5-13(11)16/h3-5H,2,6-10H2,1H3/p+1