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

Systemtic Name: 8-chloranyl-N-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-1-ium-3-yl]-N-methyl-quinoline-2-carboxamide Openeye Name: 8-chloro-N-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-1-ium-3-yl]-N-methyl-quinoline-2-carboxamide CAS Name: 8-chloro-N-[(3S)-1-[(2-fluorophenyl)methyl]-3-piperidin-1-iumyl]-N-methyl-2-quinolinecarboxamide IUPAC Name: 8-chloro-N-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-1-ium-3-yl]-N-methylquinoline-2-carboxamide Traditional Name: 8-chloro-N-[(3S)-1-(2-fluorobenzyl)piperidin-1-ium-3-yl]-N-methyl-quinaldamide Formula: C23H24ClFN3O+ MolecularWeight: 412.907563

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCC[NH+](C1)CC2=CC=CC=C2F)C(=O)C3=NC4=C(C=CC=C4Cl)C=C3

Isomeric SMILES

CN([C@H]1CCC[NH+](C1)CC2=CC=CC=C2F)C(=O)C3=NC4=C(C=CC=C4Cl)C=C3

InChI

InChI=1S/C23H23ClFN3O/c1-27(23(29)21-12-11-16-7-4-9-19(24)22(16)26-21)18-8-5-13-28(15-18)14-17-6-2-3-10-20(17)25/h2-4,6-7,9-12,18H,5,8,13-15H2,1H3/p+1/t18-/m0/s1