2-[(2S)-3-ethanoyl-4-oxidanyl-5-oxidanylidene-2-pyridin-2-yl-2H-pyrrol-1-yl]ethyl-(2-hydroxyethyl)azanium

Systemtic Name: 2-[(2S)-3-ethanoyl-4-oxidanyl-5-oxidanylidene-2-pyridin-2-yl-2H-pyrrol-1-yl]ethyl-(2-hydroxyethyl)azanium Openeye Name: 2-[(2S)-3-acetyl-4-hydroxy-5-oxo-2-(2-pyridyl)-2H-pyrrol-1-yl]ethyl-(2-hydroxyethyl)ammonium CAS Name: 2-[(2S)-3-acetyl-4-hydroxy-5-oxo-2-(2-pyridinyl)-2H-pyrrol-1-yl]ethyl-(2-hydroxyethyl)ammonium IUPAC Name: 2-[(2S)-3-acetyl-4-hydroxy-5-oxo-2-pyridin-2-yl-2H-pyrrol-1-yl]ethyl-(2-hydroxyethyl)azanium Traditional Name: 2-[(5S)-4-acetyl-3-hydroxy-2-keto-5-(2-pyridyl)-3-pyrrolin-1-yl]ethyl-(2-hydroxyethyl)ammonium Formula: C15H20N3O4+ MolecularWeight: 306.337

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C(=O)N(C1C2=CC=CC=N2)CC[NH2+]CCO)O

Isomeric SMILES

CC(=O)C1=C(C(=O)N([C@@H]1C2=CC=CC=N2)CC[NH2+]CCO)O

InChI

InChI=1S/C15H19N3O4/c1-10(20)12-13(11-4-2-3-5-17-11)18(15(22)14(12)21)8-6-16-7-9-19/h2-5,13,16,19,21H,6-9H2,1H3/p+1/t13-/m1/s1