N-[(2-fluorophenyl)methyl]-3-[(3R)-1-(quinolin-6-ylmethyl)piperidin-1-ium-3-yl]propanamide

Systemtic Name: N-[(2-fluorophenyl)methyl]-3-[(3R)-1-(quinolin-6-ylmethyl)piperidin-1-ium-3-yl]propanamide Openeye Name: N-[(2-fluorophenyl)methyl]-3-[(3R)-1-(6-quinolylmethyl)piperidin-1-ium-3-yl]propanamide CAS Name: N-[(2-fluorophenyl)methyl]-3-[(3R)-1-(6-quinolinylmethyl)-3-piperidin-1-iumyl]propanamide IUPAC Name: N-[(2-fluorophenyl)methyl]-3-[(3R)-1-(quinolin-6-ylmethyl)piperidin-1-ium-3-yl]propanamide Traditional Name: N-(2-fluorobenzyl)-3-[(3R)-1-(6-quinolylmethyl)piperidin-1-ium-3-yl]propionamide Formula: C25H29FN3O+ MolecularWeight: 406.515663

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC2=CC3=C(C=C2)N=CC=C3)CCC(=O)NCC4=CC=CC=C4F

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CC2=CC3=C(C=C2)N=CC=C3)CCC(=O)NCC4=CC=CC=C4F

InChI

InChI=1S/C25H28FN3O/c26-23-8-2-1-6-22(23)16-28-25(30)12-10-19-5-4-14-29(17-19)18-20-9-11-24-21(15-20)7-3-13-27-24/h1-3,6-9,11,13,15,19H,4-5,10,12,14,16-18H2,(H,28,30)/p+1/t19-/m1/s1