N-[3-(3-fluorophenyl)phenyl]-1-(quinolin-8-ylmethyl)piperidin-1-ium-4-carboxamide

Systemtic Name: N-[3-(3-fluorophenyl)phenyl]-1-(quinolin-8-ylmethyl)piperidin-1-ium-4-carboxamide Openeye Name: N-[3-(3-fluorophenyl)phenyl]-1-(8-quinolylmethyl)piperidin-1-ium-4-carboxamide CAS Name: N-[3-(3-fluorophenyl)phenyl]-1-(8-quinolinylmethyl)-4-piperidin-1-iumcarboxamide IUPAC Name: N-[3-(3-fluorophenyl)phenyl]-1-(quinolin-8-ylmethyl)piperidin-1-ium-4-carboxamide Traditional Name: N-[3-(3-fluorophenyl)phenyl]-1-(8-quinolylmethyl)piperidin-1-ium-4-carboxamide Formula: C28H27FN3O+ MolecularWeight: 440.531883

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)NC2=CC=CC(=C2)C3=CC(=CC=C3)F)CC4=CC=CC5=C4N=CC=C5

Isomeric SMILES

C1C[NH+](CCC1C(=O)NC2=CC=CC(=C2)C3=CC(=CC=C3)F)CC4=CC=CC5=C4N=CC=C5

InChI

InChI=1S/C28H26FN3O/c29-25-10-2-6-22(17-25)23-7-3-11-26(18-23)31-28(33)21-12-15-32(16-13-21)19-24-8-1-5-20-9-4-14-30-27(20)24/h1-11,14,17-18,21H,12-13,15-16,19H2,(H,31,33)/p+1