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

Systemtic Name: [2-chloranyl-6-[(2S,6S)-2,6-dimethylpiperidin-1-yl]phenyl]methylazanium Openeye Name: [2-chloro-6-[(2S,6S)-2,6-dimethyl-1-piperidyl]phenyl]methylammonium CAS Name: [2-chloro-6-[(2S,6S)-2,6-dimethyl-1-piperidinyl]phenyl]methylammonium IUPAC Name: [2-chloro-6-[(2S,6S)-2,6-dimethylpiperidin-1-yl]phenyl]methylazanium Traditional Name: [2-chloro-6-[(2S,6S)-2,6-dimethylpiperidino]benzyl]ammonium Formula: C14H22ClN2+ MolecularWeight: 253.79088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1C2=C(C(=CC=C2)Cl)C[NH3+])C

Isomeric SMILES

C[C@H]1CCC[C@@H](N1C2=C(C(=CC=C2)Cl)C[NH3+])C

InChI

InChI=1S/C14H21ClN2/c1-10-5-3-6-11(2)17(10)14-8-4-7-13(15)12(14)9-16/h4,7-8,10-11H,3,5-6,9,16H2,1-2H3/p+1/t10-,11-/m0/s1