7-chloranyl-2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-4-methyl-quinolin-1-ium

Systemtic Name: 7-chloranyl-2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-4-methyl-quinolin-1-ium Openeye Name: 7-chloro-2-[(3R,5R)-3,5-dimethyl-1-piperidyl]-4-methyl-quinolin-1-ium CAS Name: 7-chloro-2-[(3R,5R)-3,5-dimethyl-1-piperidinyl]-4-methylquinolin-1-ium IUPAC Name: 7-chloro-2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-4-methylquinolin-1-ium Traditional Name: 7-chloro-2-[(3R,5R)-3,5-dimethylpiperidino]-4-methyl-quinolin-1-ium Formula: C17H22ClN2+ MolecularWeight: 289.82298

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C2=[NH+]C3=C(C=CC(=C3)Cl)C(=C2)C)C

Isomeric SMILES

C[C@@H]1C[C@H](CN(C1)C2=[NH+]C3=C(C=CC(=C3)Cl)C(=C2)C)C

InChI

InChI=1S/C17H21ClN2/c1-11-6-12(2)10-20(9-11)17-7-13(3)15-5-4-14(18)8-16(15)19-17/h4-5,7-8,11-12H,6,9-10H2,1-3H3/p+1/t11-,12-/m1/s1