N-[(2S)-2-(furan-2-yl)-2-piperidin-1-ium-1-yl-ethyl]-2-oxidanylidene-1H-pyridine-3-carboxamide

Systemtic Name: N-[(2S)-2-(furan-2-yl)-2-piperidin-1-ium-1-yl-ethyl]-2-oxidanylidene-1H-pyridine-3-carboxamide Openeye Name: N-[(2S)-2-(2-furyl)-2-piperidin-1-ium-1-yl-ethyl]-2-oxo-1H-pyridine-3-carboxamide CAS Name: N-[(2S)-2-(2-furanyl)-2-(1-piperidin-1-iumyl)ethyl]-2-oxo-1H-pyridine-3-carboxamide IUPAC Name: N-[(2S)-2-(furan-2-yl)-2-piperidin-1-ium-1-ylethyl]-2-oxo-1H-pyridine-3-carboxamide Traditional Name: N-[(2S)-2-(2-furyl)-2-piperidin-1-ium-1-yl-ethyl]-2-keto-1H-pyridine-3-carboxamide Formula: C17H22N3O3+ MolecularWeight: 316.37488

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)C(CNC(=O)C2=CC=CNC2=O)C3=CC=CO3

Isomeric SMILES

C1CC[NH+](CC1)[C@@H](CNC(=O)C2=CC=CNC2=O)C3=CC=CO3

InChI

InChI=1S/C17H21N3O3/c21-16-13(6-4-8-18-16)17(22)19-12-14(15-7-5-11-23-15)20-9-2-1-3-10-20/h4-8,11,14H,1-3,9-10,12H2,(H,18,21)(H,19,22)/p+1/t14-/m0/s1