1-[4-[(3,4-dichlorophenyl)methyl]piperazin-4-ium-1-yl]propan-1-one

Systemtic Name: 1-[4-[(3,4-dichlorophenyl)methyl]piperazin-4-ium-1-yl]propan-1-one Openeye Name: 1-[4-[(3,4-dichlorophenyl)methyl]piperazin-4-ium-1-yl]propan-1-one CAS Name: 1-[4-[(3,4-dichlorophenyl)methyl]-1-piperazin-4-iumyl]-1-propanone IUPAC Name: 1-[4-[(3,4-dichlorophenyl)methyl]piperazin-4-ium-1-yl]propan-1-one Traditional Name: 1-[4-(3,4-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=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

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

InChI

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