[2-[[(2S,6S)-2,6-dimethylpiperidin-1-ium-1-yl]methyl]phenyl]methylazanium

Systemtic Name: [2-[[(2S,6S)-2,6-dimethylpiperidin-1-ium-1-yl]methyl]phenyl]methylazanium Openeye Name: [2-[[(2S,6S)-2,6-dimethylpiperidin-1-ium-1-yl]methyl]phenyl]methylammonium CAS Name: [2-[[(2S,6S)-2,6-dimethyl-1-piperidin-1-iumyl]methyl]phenyl]methylammonium IUPAC Name: [2-[[(2S,6S)-2,6-dimethylpiperidin-1-ium-1-yl]methyl]phenyl]methylazanium Traditional Name: [2-[[(2S,6S)-2,6-dimethylpiperidin-1-ium-1-yl]methyl]benzyl]ammonium Formula: C15H26N2+2 MolecularWeight: 234.38034

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC([NH+]1CC2=CC=CC=C2C[NH3+])C

Isomeric SMILES

C[C@H]1CCC[C@@H]([NH+]1CC2=CC=CC=C2C[NH3+])C

InChI

InChI=1S/C15H24N2/c1-12-6-5-7-13(2)17(12)11-15-9-4-3-8-14(15)10-16/h3-4,8-9,12-13H,5-7,10-11,16H2,1-2H3/p+2/t12-,13-/m0/s1