(2,6-dimethylquinolin-4-yl)-[(3R,4R)-3-oxidanyl-4-(4-oxidanylpiperidin-1-ium-1-yl)piperidin-1-yl]methanone

Systemtic Name: (2,6-dimethylquinolin-4-yl)-[(3R,4R)-3-oxidanyl-4-(4-oxidanylpiperidin-1-ium-1-yl)piperidin-1-yl]methanone Openeye Name: (2,6-dimethyl-4-quinolyl)-[(3R,4R)-3-hydroxy-4-(4-hydroxypiperidin-1-ium-1-yl)-1-piperidyl]methanone CAS Name: (2,6-dimethyl-4-quinolinyl)-[(3R,4R)-3-hydroxy-4-(4-hydroxy-1-piperidin-1-iumyl)-1-piperidinyl]methanone IUPAC Name: (2,6-dimethylquinolin-4-yl)-[(3R,4R)-3-hydroxy-4-(4-hydroxypiperidin-1-ium-1-yl)piperidin-1-yl]methanone Traditional Name: (2,6-dimethyl-4-quinolyl)-[(3R,4R)-3-hydroxy-4-(4-hydroxypiperidin-1-ium-1-yl)piperidino]methanone Formula: C22H30N3O3+ MolecularWeight: 384.4919

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2C(=O)N3CCC(C(C3)O)[NH+]4CCC(CC4)O)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2C(=O)N3CC[C@H]([C@@H](C3)O)[NH+]4CCC(CC4)O)C

InChI

InChI=1S/C22H29N3O3/c1-14-3-4-19-17(11-14)18(12-15(2)23-19)22(28)25-10-7-20(21(27)13-25)24-8-5-16(26)6-9-24/h3-4,11-12,16,20-21,26-27H,5-10,13H2,1-2H3/p+1/t20-,21-/m1/s1