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

Systemtic Name: 6-[[(2S,6S)-2,6-dimethylpiperidin-1-ium-1-yl]methyl]-1,2,3,4-tetrahydroquinoline Openeye Name: 6-[[(2S,6S)-2,6-dimethylpiperidin-1-ium-1-yl]methyl]-1,2,3,4-tetrahydroquinoline CAS Name: 6-[[(2S,6S)-2,6-dimethyl-1-piperidin-1-iumyl]methyl]-1,2,3,4-tetrahydroquinoline IUPAC Name: 6-[[(2S,6S)-2,6-dimethylpiperidin-1-ium-1-yl]methyl]-1,2,3,4-tetrahydroquinoline Traditional Name: 6-[[(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=CC3=C(C=C2)NCCC3)C

Isomeric SMILES

C[C@H]1CCC[C@@H]([NH+]1CC2=CC3=C(C=C2)NCCC3)C

InChI

InChI=1S/C17H26N2/c1-13-5-3-6-14(2)19(13)12-15-8-9-17-16(11-15)7-4-10-18-17/h8-9,11,13-14,18H,3-7,10,12H2,1-2H3/p+1/t13-,14-/m0/s1