N-[[(3R)-1-[[4-(furan-2-yl)phenyl]methyl]piperidin-1-ium-3-yl]methyl]pyridine-3-carboxamide

Systemtic Name: N-[[(3R)-1-[[4-(furan-2-yl)phenyl]methyl]piperidin-1-ium-3-yl]methyl]pyridine-3-carboxamide Openeye Name: N-[[(3R)-1-[[4-(2-furyl)phenyl]methyl]piperidin-1-ium-3-yl]methyl]pyridine-3-carboxamide CAS Name: N-[[(3R)-1-[[4-(2-furanyl)phenyl]methyl]-3-piperidin-1-iumyl]methyl]-3-pyridinecarboxamide IUPAC Name: N-[[(3R)-1-[[4-(furan-2-yl)phenyl]methyl]piperidin-1-ium-3-yl]methyl]pyridine-3-carboxamide Traditional Name: N-[[(3R)-1-[4-(2-furyl)benzyl]piperidin-1-ium-3-yl]methyl]nicotinamide Formula: C23H26N3O2+ MolecularWeight: 376.47144

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC2=CC=C(C=C2)C3=CC=CO3)CNC(=O)C4=CN=CC=C4

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CC2=CC=C(C=C2)C3=CC=CO3)CNC(=O)C4=CN=CC=C4

InChI

InChI=1S/C23H25N3O2/c27-23(21-5-1-11-24-15-21)25-14-19-4-2-12-26(17-19)16-18-7-9-20(10-8-18)22-6-3-13-28-22/h1,3,5-11,13,15,19H,2,4,12,14,16-17H2,(H,25,27)/p+1/t19-/m1/s1