3-chloranyl-4-[4-[(2-chlorophenyl)methyl]piperazin-4-ium-1-yl]aniline

Systemtic Name: 3-chloranyl-4-[4-[(2-chlorophenyl)methyl]piperazin-4-ium-1-yl]aniline Openeye Name: 3-chloro-4-[4-[(2-chlorophenyl)methyl]piperazin-4-ium-1-yl]aniline CAS Name: 3-chloro-4-[4-[(2-chlorophenyl)methyl]-1-piperazin-4-iumyl]aniline IUPAC Name: 3-chloro-4-[4-[(2-chlorophenyl)methyl]piperazin-4-ium-1-yl]aniline Traditional Name: [3-chloro-4-[4-(2-chlorobenzyl)piperazin-4-ium-1-yl]phenyl]amine Formula: C17H20Cl2N3+ MolecularWeight: 337.2668

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2Cl)C3=C(C=C(C=C3)N)Cl

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2Cl)C3=C(C=C(C=C3)N)Cl

InChI

InChI=1S/C17H19Cl2N3/c18-15-4-2-1-3-13(15)12-21-7-9-22(10-8-21)17-6-5-14(20)11-16(17)19/h1-6,11H,7-10,12,20H2/p+1