8-[[(2S,6S)-2,6-dimethylpiperidin-1-ium-1-yl]methyl]-1,2,3,4-tetrahydroquinoline

Systemtic Name: 8-[[(2S,6S)-2,6-dimethylpiperidin-1-ium-1-yl]methyl]-1,2,3,4-tetrahydroquinoline Openeye Name: 8-[[(2S,6S)-2,6-dimethylpiperidin-1-ium-1-yl]methyl]-1,2,3,4-tetrahydroquinoline CAS Name: 8-[[(2S,6S)-2,6-dimethyl-1-piperidin-1-iumyl]methyl]-1,2,3,4-tetrahydroquinoline IUPAC Name: 8-[[(2S,6S)-2,6-dimethylpiperidin-1-ium-1-yl]methyl]-1,2,3,4-tetrahydroquinoline Traditional Name: 8-[[(2S,6S)-2,6-dimethylpiperidin-1-ium-1-yl]methyl]-1,2,3,4-tetrahydroquinoline Formula: C17H27N2+ MolecularWeight: 259.40968

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC([NH+]1CC2=CC=CC3=C2NCCC3)C

Isomeric SMILES

C[C@H]1CCC[C@@H]([NH+]1CC2=CC=CC3=C2NCCC3)C

InChI

InChI=1S/C17H26N2/c1-13-6-3-7-14(2)19(13)12-16-9-4-8-15-10-5-11-18-17(15)16/h4,8-9,13-14,18H,3,5-7,10-12H2,1-2H3/p+1/t13-,14-/m0/s1