2-(3-fluorophenyl)-1-[(3R,4R)-3-oxidanyl-4-(4-oxidanylpiperidin-1-ium-1-yl)piperidin-1-yl]ethanone

Systemtic Name: 2-(3-fluorophenyl)-1-[(3R,4R)-3-oxidanyl-4-(4-oxidanylpiperidin-1-ium-1-yl)piperidin-1-yl]ethanone Openeye Name: 2-(3-fluorophenyl)-1-[(3R,4R)-3-hydroxy-4-(4-hydroxypiperidin-1-ium-1-yl)-1-piperidyl]ethanone CAS Name: 2-(3-fluorophenyl)-1-[(3R,4R)-3-hydroxy-4-(4-hydroxy-1-piperidin-1-iumyl)-1-piperidinyl]ethanone IUPAC Name: 2-(3-fluorophenyl)-1-[(3R,4R)-3-hydroxy-4-(4-hydroxypiperidin-1-ium-1-yl)piperidin-1-yl]ethanone Traditional Name: 2-(3-fluorophenyl)-1-[(3R,4R)-3-hydroxy-4-(4-hydroxypiperidin-1-ium-1-yl)piperidino]ethanone Formula: C18H26FN2O3+ MolecularWeight: 337.409043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1O)C2CCN(CC2O)C(=O)CC3=CC(=CC=C3)F

Isomeric SMILES

C1CN(C[C@H]([C@@H]1[NH+]2CCC(CC2)O)O)C(=O)CC3=CC(=CC=C3)F

InChI

InChI=1S/C18H25FN2O3/c19-14-3-1-2-13(10-14)11-18(24)21-9-6-16(17(23)12-21)20-7-4-15(22)5-8-20/h1-3,10,15-17,22-23H,4-9,11-12H2/p+1/t16-,17-/m1/s1