(2S)-2-(2-methylpropyl)-1-(phenylmethyl)piperazin-4-ium

Systemtic Name: (2S)-2-(2-methylpropyl)-1-(phenylmethyl)piperazin-4-ium Openeye Name: (2S)-1-benzyl-2-isobutyl-piperazin-4-ium CAS Name: (2S)-2-(2-methylpropyl)-1-(phenylmethyl)piperazin-4-ium IUPAC Name: (2S)-1-benzyl-2-(2-methylpropyl)piperazin-4-ium Traditional Name: (2S)-1-benzyl-2-isobutyl-piperazin-4-ium Formula: C15H25N2+ MolecularWeight: 233.3724

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1C[NH2+]CCN1CC2=CC=CC=C2

Isomeric SMILES

CC(C)C[C@H]1C[NH2+]CCN1CC2=CC=CC=C2

InChI

InChI=1S/C15H24N2/c1-13(2)10-15-11-16-8-9-17(15)12-14-6-4-3-5-7-14/h3-7,13,15-16H,8-12H2,1-2H3/p+1/t15-/m0/s1