4-fluoranyl-N-[[(3R)-1-[(5-methyl-2-pyrazol-1-yl-phenyl)methyl]piperidin-1-ium-3-yl]methyl]benzamide

Systemtic Name: 4-fluoranyl-N-[[(3R)-1-[(5-methyl-2-pyrazol-1-yl-phenyl)methyl]piperidin-1-ium-3-yl]methyl]benzamide Openeye Name: 4-fluoro-N-[[(3R)-1-[(5-methyl-2-pyrazol-1-yl-phenyl)methyl]piperidin-1-ium-3-yl]methyl]benzamide CAS Name: 4-fluoro-N-[[(3R)-1-[[5-methyl-2-(1-pyrazolyl)phenyl]methyl]-3-piperidin-1-iumyl]methyl]benzamide IUPAC Name: 4-fluoro-N-[[(3R)-1-[(5-methyl-2-pyrazol-1-ylphenyl)methyl]piperidin-1-ium-3-yl]methyl]benzamide Traditional Name: 4-fluoro-N-[[(3R)-1-(5-methyl-2-pyrazol-1-yl-benzyl)piperidin-1-ium-3-yl]methyl]benzamide Formula: C24H28FN4O+ MolecularWeight: 407.503723

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C=CC=N2)C[NH+]3CCCC(C3)CNC(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC(=C(C=C1)N2C=CC=N2)C[NH+]3CCC[C@@H](C3)CNC(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C24H27FN4O/c1-18-5-10-23(29-13-3-11-27-29)21(14-18)17-28-12-2-4-19(16-28)15-26-24(30)20-6-8-22(25)9-7-20/h3,5-11,13-14,19H,2,4,12,15-17H2,1H3,(H,26,30)/p+1/t19-/m1/s1