2-oxidanylidene-N-[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]-1H-pyridine-3-carboxamide

Systemtic Name: 2-oxidanylidene-N-[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]-1H-pyridine-3-carboxamide Openeye Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-2-oxo-1H-pyridine-3-carboxamide CAS Name: 2-oxo-N-[(3S)-1-(phenylmethyl)-3-pyrrolidin-1-iumyl]-1H-pyridine-3-carboxamide IUPAC Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-2-oxo-1H-pyridine-3-carboxamide Traditional Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-2-keto-1H-pyridine-3-carboxamide Formula: C17H20N3O2+ MolecularWeight: 298.3596

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC1NC(=O)C2=CC=CNC2=O)CC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](C[C@H]1NC(=O)C2=CC=CNC2=O)CC3=CC=CC=C3

InChI

InChI=1S/C17H19N3O2/c21-16-15(7-4-9-18-16)17(22)19-14-8-10-20(12-14)11-13-5-2-1-3-6-13/h1-7,9,14H,8,10-12H2,(H,18,21)(H,19,22)/p+1/t14-/m0/s1