(4E)-5-(hydroxymethyl)-1,2-dimethyl-4-[(oxidanylamino)methylidene]pyridin-1-ium-3-one

Systemtic Name: (4E)-5-(hydroxymethyl)-1,2-dimethyl-4-[(oxidanylamino)methylidene]pyridin-1-ium-3-one Openeye Name: (4E)-4-[(hydroxyamino)methylene]-5-(hydroxymethyl)-1,2-dimethyl-pyridin-1-ium-3-one CAS Name: (4E)-4-[(hydroxyamino)methylidene]-5-(hydroxymethyl)-1,2-dimethyl-3-pyridin-1-iumone IUPAC Name: (4E)-4-[(hydroxyamino)methylidene]-5-(hydroxymethyl)-1,2-dimethylpyridin-1-ium-3-one Traditional Name: (4E)-4-[(hydroxyamino)methylene]-1,2-dimethyl-5-methylol-pyridin-1-ium-3-one Formula: C9H13N2O3+ MolecularWeight: 197.21112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C=C(C(=CNO)C1=O)CO)C

Isomeric SMILES

CC1=[N+](C=C(/C(=C\NO)/C1=O)CO)C

InChI

InChI=1S/C9H12N2O3/c1-6-9(13)8(3-10-14)7(5-12)4-11(6)2/h3-4,12H,5H2,1-2H3,(H-,10,13,14)/p+1