N-[(4-fluorophenyl)methyl]-3-[1-[(5-phenyl-1H-pyrazol-4-yl)methyl]piperidin-1-ium-4-yl]propanamide

Systemtic Name: N-[(4-fluorophenyl)methyl]-3-[1-[(5-phenyl-1H-pyrazol-4-yl)methyl]piperidin-1-ium-4-yl]propanamide Openeye Name: N-[(4-fluorophenyl)methyl]-3-[1-[(5-phenyl-1H-pyrazol-4-yl)methyl]piperidin-1-ium-4-yl]propanamide CAS Name: N-[(4-fluorophenyl)methyl]-3-[1-[(5-phenyl-1H-pyrazol-4-yl)methyl]-4-piperidin-1-iumyl]propanamide IUPAC Name: N-[(4-fluorophenyl)methyl]-3-[1-[(5-phenyl-1H-pyrazol-4-yl)methyl]piperidin-1-ium-4-yl]propanamide Traditional Name: N-(4-fluorobenzyl)-3-[1-[(5-phenyl-1H-pyrazol-4-yl)methyl]piperidin-1-ium-4-yl]propionamide Formula: C25H30FN4O+ MolecularWeight: 421.530303

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1CCC(=O)NCC2=CC=C(C=C2)F)CC3=C(NN=C3)C4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CCC1CCC(=O)NCC2=CC=C(C=C2)F)CC3=C(NN=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H29FN4O/c26-23-9-6-20(7-10-23)16-27-24(31)11-8-19-12-14-30(15-13-19)18-22-17-28-29-25(22)21-4-2-1-3-5-21/h1-7,9-10,17,19H,8,11-16,18H2,(H,27,31)(H,28,29)/p+1