[2-[(2S,6S)-2,6-dimethylpiperidin-1-yl]quinolin-1-ium-3-yl]methylazanium

Systemtic Name: [2-[(2S,6S)-2,6-dimethylpiperidin-1-yl]quinolin-1-ium-3-yl]methylazanium Openeye Name: [2-[(2S,6S)-2,6-dimethyl-1-piperidyl]quinolin-1-ium-3-yl]methylammonium CAS Name: [2-[(2S,6S)-2,6-dimethyl-1-piperidinyl]-3-quinolin-1-iumyl]methylammonium IUPAC Name: [2-[(2S,6S)-2,6-dimethylpiperidin-1-yl]quinolin-1-ium-3-yl]methylazanium Traditional Name: [2-[(2S,6S)-2,6-dimethylpiperidino]quinolin-1-ium-3-yl]methylammonium Formula: C17H25N3+2 MolecularWeight: 271.4005

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1C2=[NH+]C3=CC=CC=C3C=C2C[NH3+])C

Isomeric SMILES

C[C@H]1CCC[C@@H](N1C2=[NH+]C3=CC=CC=C3C=C2C[NH3+])C

InChI

InChI=1S/C17H23N3/c1-12-6-5-7-13(2)20(12)17-15(11-18)10-14-8-3-4-9-16(14)19-17/h3-4,8-10,12-13H,5-7,11,18H2,1-2H3/p+2/t12-,13-/m0/s1