(3S)-N-[(8-fluoranylquinolin-2-yl)methyl]-1-(3-phenylpropyl)piperidin-1-ium-3-amine

Systemtic Name: (3S)-N-[(8-fluoranylquinolin-2-yl)methyl]-1-(3-phenylpropyl)piperidin-1-ium-3-amine Openeye Name: (3S)-N-[(8-fluoro-2-quinolyl)methyl]-1-(3-phenylpropyl)piperidin-1-ium-3-amine CAS Name: (3S)-N-[(8-fluoro-2-quinolinyl)methyl]-1-(3-phenylpropyl)-3-piperidin-1-iumamine IUPAC Name: (3S)-N-[(8-fluoroquinolin-2-yl)methyl]-1-(3-phenylpropyl)piperidin-1-ium-3-amine Traditional Name: (8-fluoro-2-quinolyl)methyl-[(3S)-1-(3-phenylpropyl)piperidin-1-ium-3-yl]amine Formula: C24H29FN3+ MolecularWeight: 378.505563

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CCCC2=CC=CC=C2)NCC3=NC4=C(C=CC=C4F)C=C3

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CCCC2=CC=CC=C2)NCC3=NC4=C(C=CC=C4F)C=C3

InChI

InChI=1S/C24H28FN3/c25-23-12-4-10-20-13-14-21(27-24(20)23)17-26-22-11-6-16-28(18-22)15-5-9-19-7-2-1-3-8-19/h1-4,7-8,10,12-14,22,26H,5-6,9,11,15-18H2/p+1/t22-/m0/s1