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

Systemtic Name: N-[2-[1-[[3-(2-hydroxyethyloxy)phenyl]methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]cyclopropanecarboxamide Openeye Name: N-[2-[1-[[3-(2-hydroxyethoxy)phenyl]methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]cyclopropanecarboxamide CAS Name: N-[2-[1-[[3-(2-hydroxyethoxy)phenyl]methyl]-4-piperidin-1-iumyl]-3-pyrazolyl]cyclopropanecarboxamide IUPAC Name: N-[2-[1-[[3-(2-hydroxyethoxy)phenyl]methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]cyclopropanecarboxamide Traditional Name: N-[2-[1-[3-(2-hydroxyethoxy)benzyl]piperidin-1-ium-4-yl]pyrazol-3-yl]cyclopropanecarboxamide Formula: C21H29N4O3+ MolecularWeight: 385.47996

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)NC2=CC=NN2C3CC[NH+](CC3)CC4=CC(=CC=C4)OCCO

Isomeric SMILES

C1CC1C(=O)NC2=CC=NN2C3CC[NH+](CC3)CC4=CC(=CC=C4)OCCO

InChI

InChI=1S/C21H28N4O3/c26-12-13-28-19-3-1-2-16(14-19)15-24-10-7-18(8-11-24)25-20(6-9-22-25)23-21(27)17-4-5-17/h1-3,6,9,14,17-18,26H,4-5,7-8,10-13,15H2,(H,23,27)/p+1