8-fluoranyl-N-methyl-N-[(3S)-1-(3-phenylpropyl)piperidin-1-ium-3-yl]quinoline-2-carboxamide

Systemtic Name: 8-fluoranyl-N-methyl-N-[(3S)-1-(3-phenylpropyl)piperidin-1-ium-3-yl]quinoline-2-carboxamide Openeye Name: 8-fluoro-N-methyl-N-[(3S)-1-(3-phenylpropyl)piperidin-1-ium-3-yl]quinoline-2-carboxamide CAS Name: 8-fluoro-N-methyl-N-[(3S)-1-(3-phenylpropyl)-3-piperidin-1-iumyl]-2-quinolinecarboxamide IUPAC Name: 8-fluoro-N-methyl-N-[(3S)-1-(3-phenylpropyl)piperidin-1-ium-3-yl]quinoline-2-carboxamide Traditional Name: 8-fluoro-N-methyl-N-[(3S)-1-(3-phenylpropyl)piperidin-1-ium-3-yl]quinaldamide Formula: C25H29FN3O+ MolecularWeight: 406.515663

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCC[NH+](C1)CCCC2=CC=CC=C2)C(=O)C3=NC4=C(C=CC=C4F)C=C3

Isomeric SMILES

CN([C@H]1CCC[NH+](C1)CCCC2=CC=CC=C2)C(=O)C3=NC4=C(C=CC=C4F)C=C3

InChI

InChI=1S/C25H28FN3O/c1-28(25(30)23-15-14-20-11-5-13-22(26)24(20)27-23)21-12-7-17-29(18-21)16-6-10-19-8-3-2-4-9-19/h2-5,8-9,11,13-15,21H,6-7,10,12,16-18H2,1H3/p+1/t21-/m0/s1