(4Z)-5-(hydroxymethyl)-1,2-dimethyl-4-[(2-pyrimidin-2-ylhydrazinyl)methylidene]pyridin-1-ium-3-one iodide

Systemtic Name: (4Z)-5-(hydroxymethyl)-1,2-dimethyl-4-[(2-pyrimidin-2-ylhydrazinyl)methylidene]pyridin-1-ium-3-one iodide Openeye Name: (4Z)-5-(hydroxymethyl)-1,2-dimethyl-4-[(2-pyrimidin-2-ylhydrazino)methylene]pyridin-1-ium-3-one iodide CAS Name: (4Z)-5-(hydroxymethyl)-1,2-dimethyl-4-[(2-pyrimidinylhydrazo)methylidene]-3-pyridin-1-iumone iodide IUPAC Name: (4Z)-5-(hydroxymethyl)-1,2-dimethyl-4-[(2-pyrimidin-2-ylhydrazinyl)methylidene]pyridin-1-ium-3-one iodide Traditional Name: (4Z)-1,2-dimethyl-5-methylol-4-[[N'-(2-pyrimidyl)hydrazino]methylene]pyridin-1-ium-3-one iodide Formula: C13H16IN5O2 MolecularWeight: 401.20291

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C=C(C(=CNNC2=NC=CC=N2)C1=O)CO)C.[I-]

Isomeric SMILES

CC1=[N+](C=C(/C(=C/NNC2=NC=CC=N2)/C1=O)CO)C.[I-]

InChI

InChI=1S/C13H15N5O2.HI/c1-9-12(20)11(10(8-19)7-18(9)2)6-16-17-13-14-4-3-5-15-13;/h3-7,19-20H,8H2,1-2H3;1H/b11-6-;