3-[1-[(6-fluoranylquinolin-2-yl)methyl]piperidin-1-ium-4-yl]-1-morpholin-4-yl-propan-1-one

Systemtic Name: 3-[1-[(6-fluoranylquinolin-2-yl)methyl]piperidin-1-ium-4-yl]-1-morpholin-4-yl-propan-1-one Openeye Name: 3-[1-[(6-fluoro-2-quinolyl)methyl]piperidin-1-ium-4-yl]-1-morpholino-propan-1-one CAS Name: 3-[1-[(6-fluoro-2-quinolinyl)methyl]-4-piperidin-1-iumyl]-1-(4-morpholinyl)-1-propanone IUPAC Name: 3-[1-[(6-fluoroquinolin-2-yl)methyl]piperidin-1-ium-4-yl]-1-morpholin-4-ylpropan-1-one Traditional Name: 3-[1-[(6-fluoro-2-quinolyl)methyl]piperidin-1-ium-4-yl]-1-morpholino-propan-1-one Formula: C22H29FN3O2+ MolecularWeight: 386.482963

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1CCC(=O)N2CCOCC2)CC3=NC4=C(C=C3)C=C(C=C4)F

Isomeric SMILES

C1C[NH+](CCC1CCC(=O)N2CCOCC2)CC3=NC4=C(C=C3)C=C(C=C4)F

InChI

InChI=1S/C22H28FN3O2/c23-19-3-5-21-18(15-19)2-4-20(24-21)16-25-9-7-17(8-10-25)1-6-22(27)26-11-13-28-14-12-26/h2-5,15,17H,1,6-14,16H2/p+1