1-(3-chlorophenyl)-1,4,4-trimethyl-piperazine-1,4-diium

Systemtic Name: 1-(3-chlorophenyl)-1,4,4-trimethyl-piperazine-1,4-diium Openeye Name: 1-(3-chlorophenyl)-1,4,4-trimethyl-piperazine-1,4-diium CAS Name: 1-(3-chlorophenyl)-1,4,4-trimethylpiperazine-1,4-diium IUPAC Name: 1-(3-chlorophenyl)-1,4,4-trimethylpiperazine-1,4-diium Traditional Name: 1-(3-chlorophenyl)-1,4,4-trimethyl-piperazine-1,4-diium Formula: C13H21ClN2+2 MolecularWeight: 240.77224

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CC[N+](CC1)(C)C2=CC(=CC=C2)Cl)C

Isomeric SMILES

C[N+]1(CC[N+](CC1)(C)C2=CC(=CC=C2)Cl)C

InChI

InChI=1S/C13H21ClN2/c1-15(2)7-9-16(3,10-8-15)13-6-4-5-12(14)11-13/h4-6,11H,7-10H2,1-3H3/q+2