(2S)-2-methyl-1-(4-methylphenyl)piperazin-4-ium

Systemtic Name: (2S)-2-methyl-1-(4-methylphenyl)piperazin-4-ium Openeye Name: (2S)-2-methyl-1-(p-tolyl)piperazin-4-ium CAS Name: (2S)-2-methyl-1-(4-methylphenyl)piperazin-4-ium IUPAC Name: (2S)-2-methyl-1-(4-methylphenyl)piperazin-4-ium Traditional Name: (2S)-2-methyl-1-(p-tolyl)piperazin-4-ium Formula: C12H19N2+ MolecularWeight: 191.29266

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Descriptors Computed from Structure

Canonical SMILES:

CC1C[NH2+]CCN1C2=CC=C(C=C2)C

Isomeric SMILES

C[C@H]1C[NH2+]CCN1C2=CC=C(C=C2)C

InChI

InChI=1S/C12H18N2/c1-10-3-5-12(6-4-10)14-8-7-13-9-11(14)2/h3-6,11,13H,7-9H2,1-2H3/p+1/t11-/m0/s1