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

Systemtic Name: 1-[4-[(3,4-dichlorophenyl)methyl]piperazin-4-ium-1-yl]butan-1-one Openeye Name: 1-[4-[(3,4-dichlorophenyl)methyl]piperazin-4-ium-1-yl]butan-1-one CAS Name: 1-[4-[(3,4-dichlorophenyl)methyl]-1-piperazin-4-iumyl]-1-butanone IUPAC Name: 1-[4-[(3,4-dichlorophenyl)methyl]piperazin-4-ium-1-yl]butan-1-one Traditional Name: 1-[4-(3,4-dichlorobenzyl)piperazin-4-ium-1-yl]butan-1-one Formula: C15H21Cl2N2O+ MolecularWeight: 316.24604

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20Cl2N2O/c1-2-3-15(20)19-8-6-18(7-9-19)11-12-4-5-13(16)14(17)10-12/h4-5,10H,2-3,6-9,11H2,1H3/p+1