N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-6-oxidanylidene-1H-pyridine-3-carboxamide

Systemtic Name: N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-6-oxidanylidene-1H-pyridine-3-carboxamide Openeye Name: N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-6-oxo-1H-pyridine-3-carboxamide CAS Name: N-[[(2S)-1-ethyl-2-pyrrolidin-1-iumyl]methyl]-6-oxo-1H-pyridine-3-carboxamide IUPAC Name: N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-6-oxo-1H-pyridine-3-carboxamide Traditional Name: N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-6-keto-1H-pyridine-3-carboxamide Formula: C13H20N3O2+ MolecularWeight: 250.3168

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1CNC(=O)C2=CNC(=O)C=C2

Isomeric SMILES

CC[NH+]1CCC[C@H]1CNC(=O)C2=CNC(=O)C=C2

InChI

InChI=1S/C13H19N3O2/c1-2-16-7-3-4-11(16)9-15-13(18)10-5-6-12(17)14-8-10/h5-6,8,11H,2-4,7,9H2,1H3,(H,14,17)(H,15,18)/p+1/t11-/m0/s1