(2S,6S)-1-[(4-chlorophenyl)methyl]-2,6-dimethyl-piperazin-4-ium

Systemtic Name: (2S,6S)-1-[(4-chlorophenyl)methyl]-2,6-dimethyl-piperazin-4-ium Openeye Name: (2S,6S)-1-[(4-chlorophenyl)methyl]-2,6-dimethyl-piperazin-4-ium CAS Name: (2S,6S)-1-[(4-chlorophenyl)methyl]-2,6-dimethylpiperazin-4-ium IUPAC Name: (2S,6S)-1-[(4-chlorophenyl)methyl]-2,6-dimethylpiperazin-4-ium Traditional Name: (2S,6S)-1-(4-chlorobenzyl)-2,6-dimethyl-piperazin-4-ium Formula: C13H20ClN2+ MolecularWeight: 239.7643

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Descriptors Computed from Structure

Canonical SMILES:

CC1C[NH2+]CC(N1CC2=CC=C(C=C2)Cl)C

Isomeric SMILES

C[C@H]1C[NH2+]C[C@@H](N1CC2=CC=C(C=C2)Cl)C

InChI

InChI=1S/C13H19ClN2/c1-10-7-15-8-11(2)16(10)9-12-3-5-13(14)6-4-12/h3-6,10-11,15H,7-9H2,1-2H3/p+1/t10-,11-/m0/s1