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

Systemtic Name: 1-(2,4-dichlorophenyl)-N-[4-(phenylmethyl)piperazin-4-ium-1-yl]methanimine Openeye Name: N-(4-benzylpiperazin-4-ium-1-yl)-1-(2,4-dichlorophenyl)methanimine CAS Name: 1-(2,4-dichlorophenyl)-N-[4-(phenylmethyl)-1-piperazin-4-iumyl]methanimine IUPAC Name: N-(4-benzylpiperazin-4-ium-1-yl)-1-(2,4-dichlorophenyl)methanimine Traditional Name: (E)-(4-benzylpiperazin-4-ium-1-yl)-(2,4-dichlorobenzylidene)amine Formula: C18H20Cl2N3+ MolecularWeight: 349.2775

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2)N=CC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

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

InChI

InChI=1S/C18H19Cl2N3/c19-17-7-6-16(18(20)12-17)13-21-23-10-8-22(9-11-23)14-15-4-2-1-3-5-15/h1-7,12-13H,8-11,14H2/p+1/b21-13+