N-[4-(2-fluoranylphenoxy)phenyl]-1-[(6-methylpyridin-2-yl)methyl]piperidin-1-ium-4-carboxamide

Systemtic Name: N-[4-(2-fluoranylphenoxy)phenyl]-1-[(6-methylpyridin-2-yl)methyl]piperidin-1-ium-4-carboxamide Openeye Name: N-[4-(2-fluorophenoxy)phenyl]-1-[(6-methyl-2-pyridyl)methyl]piperidin-1-ium-4-carboxamide CAS Name: N-[4-(2-fluorophenoxy)phenyl]-1-[(6-methyl-2-pyridinyl)methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-[4-(2-fluorophenoxy)phenyl]-1-[(6-methylpyridin-2-yl)methyl]piperidin-1-ium-4-carboxamide Traditional Name: N-[4-(2-fluorophenoxy)phenyl]-1-[(6-methyl-2-pyridyl)methyl]piperidin-1-ium-4-carboxamide Formula: C25H27FN3O2+ MolecularWeight: 420.499183

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)C[NH+]2CCC(CC2)C(=O)NC3=CC=C(C=C3)OC4=CC=CC=C4F

Isomeric SMILES

CC1=NC(=CC=C1)C[NH+]2CCC(CC2)C(=O)NC3=CC=C(C=C3)OC4=CC=CC=C4F

InChI

InChI=1S/C25H26FN3O2/c1-18-5-4-6-21(27-18)17-29-15-13-19(14-16-29)25(30)28-20-9-11-22(12-10-20)31-24-8-3-2-7-23(24)26/h2-12,19H,13-17H2,1H3,(H,28,30)/p+1