1-[2,3-bis(chloranyl)phenyl]-1-[(4-methylphenyl)methyl]piperazin-1-ium

Systemtic Name: 1-[2,3-bis(chloranyl)phenyl]-1-[(4-methylphenyl)methyl]piperazin-1-ium Openeye Name: 1-(2,3-dichlorophenyl)-1-(p-tolylmethyl)piperazin-1-ium CAS Name: 1-(2,3-dichlorophenyl)-1-[(4-methylphenyl)methyl]piperazin-1-ium IUPAC Name: 1-(2,3-dichlorophenyl)-1-[(4-methylphenyl)methyl]piperazin-1-ium Traditional Name: 1-(2,3-dichlorophenyl)-1-(4-methylbenzyl)piperazin-1-ium Formula: C18H21Cl2N2+ MolecularWeight: 336.27874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[N+]2(CCNCC2)C3=C(C(=CC=C3)Cl)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C[N+]2(CCNCC2)C3=C(C(=CC=C3)Cl)Cl

InChI

InChI=1S/C18H21Cl2N2/c1-14-5-7-15(8-6-14)13-22(11-9-21-10-12-22)17-4-2-3-16(19)18(17)20/h2-8,21H,9-13H2,1H3/q+1