N-[2-[1-[[3-(2-hydroxyethyloxy)phenyl]methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]cyclopentanecarboxamide

Systemtic Name: N-[2-[1-[[3-(2-hydroxyethyloxy)phenyl]methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]cyclopentanecarboxamide Openeye Name: N-[2-[1-[[3-(2-hydroxyethoxy)phenyl]methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]cyclopentanecarboxamide CAS Name: N-[2-[1-[[3-(2-hydroxyethoxy)phenyl]methyl]-4-piperidin-1-iumyl]-3-pyrazolyl]cyclopentanecarboxamide IUPAC Name: N-[2-[1-[[3-(2-hydroxyethoxy)phenyl]methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]cyclopentanecarboxamide Traditional Name: N-[2-[1-[3-(2-hydroxyethoxy)benzyl]piperidin-1-ium-4-yl]pyrazol-3-yl]cyclopentanecarboxamide Formula: C23H33N4O3+ MolecularWeight: 413.53312

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(=O)NC2=CC=NN2C3CC[NH+](CC3)CC4=CC(=CC=C4)OCCO

Isomeric SMILES

C1CCC(C1)C(=O)NC2=CC=NN2C3CC[NH+](CC3)CC4=CC(=CC=C4)OCCO

InChI

InChI=1S/C23H32N4O3/c28-14-15-30-21-7-3-4-18(16-21)17-26-12-9-20(10-13-26)27-22(8-11-24-27)25-23(29)19-5-1-2-6-19/h3-4,7-8,11,16,19-20,28H,1-2,5-6,9-10,12-15,17H2,(H,25,29)/p+1