(2S,6S)-2,6-dimethyl-1-(phenylmethyl)piperazin-4-ium

Systemtic Name: (2S,6S)-2,6-dimethyl-1-(phenylmethyl)piperazin-4-ium Openeye Name: (2S,6S)-1-benzyl-2,6-dimethyl-piperazin-4-ium CAS Name: (2S,6S)-2,6-dimethyl-1-(phenylmethyl)piperazin-4-ium IUPAC Name: (2S,6S)-1-benzyl-2,6-dimethylpiperazin-4-ium Traditional Name: (2S,6S)-1-benzyl-2,6-dimethyl-piperazin-4-ium Formula: C13H21N2+ MolecularWeight: 205.31924

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20N2/c1-11-8-14-9-12(2)15(11)10-13-6-4-3-5-7-13/h3-7,11-12,14H,8-10H2,1-2H3/p+1/t11-,12-/m0/s1