(2,4-dichlorophenyl)-[4-(phenylmethyl)piperazin-4-ium-1-yl]methanone

Systemtic Name: (2,4-dichlorophenyl)-[4-(phenylmethyl)piperazin-4-ium-1-yl]methanone Openeye Name: (4-benzylpiperazin-4-ium-1-yl)-(2,4-dichlorophenyl)methanone CAS Name: (2,4-dichlorophenyl)-[4-(phenylmethyl)-1-piperazin-4-iumyl]methanone IUPAC Name: (4-benzylpiperazin-4-ium-1-yl)-(2,4-dichlorophenyl)methanone Traditional Name: (4-benzylpiperazin-4-ium-1-yl)-(2,4-dichlorophenyl)methanone Formula: C18H19Cl2N2O+ MolecularWeight: 350.26226

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18Cl2N2O/c19-15-6-7-16(17(20)12-15)18(23)22-10-8-21(9-11-22)13-14-4-2-1-3-5-14/h1-7,12H,8-11,13H2/p+1