N-[2-[1-[(5-ethylfuran-2-yl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]pyridine-3-carboxamide

Systemtic Name: N-[2-[1-[(5-ethylfuran-2-yl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]pyridine-3-carboxamide Openeye Name: N-[2-[1-[(5-ethyl-2-furyl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]pyridine-3-carboxamide CAS Name: N-[2-[1-[(5-ethyl-2-furanyl)methyl]-4-piperidin-1-iumyl]-3-pyrazolyl]-3-pyridinecarboxamide IUPAC Name: N-[2-[1-[(5-ethylfuran-2-yl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]pyridine-3-carboxamide Traditional Name: N-[2-[1-[(5-ethyl-2-furyl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]nicotinamide Formula: C21H26N5O2+ MolecularWeight: 380.46344

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(O1)C[NH+]2CCC(CC2)N3C(=CC=N3)NC(=O)C4=CN=CC=C4

Isomeric SMILES

CCC1=CC=C(O1)C[NH+]2CCC(CC2)N3C(=CC=N3)NC(=O)C4=CN=CC=C4

InChI

InChI=1S/C21H25N5O2/c1-2-18-5-6-19(28-18)15-25-12-8-17(9-13-25)26-20(7-11-23-26)24-21(27)16-4-3-10-22-14-16/h3-7,10-11,14,17H,2,8-9,12-13,15H2,1H3,(H,24,27)/p+1