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

Systemtic Name: N-[2-[1-[[4-(furan-2-yl)phenyl]methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]cyclopentanecarboxamide Openeye Name: N-[2-[1-[[4-(2-furyl)phenyl]methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]cyclopentanecarboxamide CAS Name: N-[2-[1-[[4-(2-furanyl)phenyl]methyl]-4-piperidin-1-iumyl]-3-pyrazolyl]cyclopentanecarboxamide IUPAC Name: N-[2-[1-[[4-(furan-2-yl)phenyl]methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]cyclopentanecarboxamide Traditional Name: N-[2-[1-[4-(2-furyl)benzyl]piperidin-1-ium-4-yl]pyrazol-3-yl]cyclopentanecarboxamide Formula: C25H31N4O2+ MolecularWeight: 419.53924

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(=O)NC2=CC=NN2C3CC[NH+](CC3)CC4=CC=C(C=C4)C5=CC=CO5

Isomeric SMILES

C1CCC(C1)C(=O)NC2=CC=NN2C3CC[NH+](CC3)CC4=CC=C(C=C4)C5=CC=CO5

InChI

InChI=1S/C25H30N4O2/c30-25(21-4-1-2-5-21)27-24-11-14-26-29(24)22-12-15-28(16-13-22)18-19-7-9-20(10-8-19)23-6-3-17-31-23/h3,6-11,14,17,21-22H,1-2,4-5,12-13,15-16,18H2,(H,27,30)/p+1