N-[2-[1-[(4-fluorophenyl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]-4-methoxy-benzamide

Systemtic Name: N-[2-[1-[(4-fluorophenyl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]-4-methoxy-benzamide Openeye Name: N-[2-[1-[(4-fluorophenyl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]-4-methoxy-benzamide CAS Name: N-[2-[1-[(4-fluorophenyl)methyl]-4-piperidin-1-iumyl]-3-pyrazolyl]-4-methoxybenzamide IUPAC Name: N-[2-[1-[(4-fluorophenyl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]-4-methoxybenzamide Traditional Name: N-[2-[1-(4-fluorobenzyl)piperidin-1-ium-4-yl]pyrazol-3-yl]-4-methoxy-benzamide Formula: C23H26FN4O2+ MolecularWeight: 409.476543

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NC2=CC=NN2C3CC[NH+](CC3)CC4=CC=C(C=C4)F

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NC2=CC=NN2C3CC[NH+](CC3)CC4=CC=C(C=C4)F

InChI

InChI=1S/C23H25FN4O2/c1-30-21-8-4-18(5-9-21)23(29)26-22-10-13-25-28(22)20-11-14-27(15-12-20)16-17-2-6-19(24)7-3-17/h2-10,13,20H,11-12,14-16H2,1H3,(H,26,29)/p+1