(4Z)-4-[(1-methylpyridin-1-ium-3-yl)methylidene]-2-phenyl-1,3-oxazol-5-one iodide

Systemtic Name: (4Z)-4-[(1-methylpyridin-1-ium-3-yl)methylidene]-2-phenyl-1,3-oxazol-5-one iodide Openeye Name: (4Z)-4-[(1-methylpyridin-1-ium-3-yl)methylene]-2-phenyl-oxazol-5-one iodide CAS Name: (4Z)-4-[(1-methyl-3-pyridin-1-iumyl)methylidene]-2-phenyl-5-oxazolone iodide IUPAC Name: (4Z)-4-[(1-methylpyridin-1-ium-3-yl)methylidene]-2-phenyl-1,3-oxazol-5-one iodide Traditional Name: (4Z)-4-[(1-methylpyridin-1-ium-3-yl)methylene]-2-phenyl-2-oxazolin-5-one iodide Formula: C16H13IN2O2 MolecularWeight: 392.19109

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=CC(=C1)C=C2C(=O)OC(=N2)C3=CC=CC=C3.[I-]

Isomeric SMILES

C[N+]1=CC=CC(=C1)/C=C\2/C(=O)OC(=N2)C3=CC=CC=C3.[I-]

InChI

InChI=1S/C16H13N2O2.HI/c1-18-9-5-6-12(11-18)10-14-16(19)20-15(17-14)13-7-3-2-4-8-13;/h2-11H,1H3;1H/q+1;/p-1/b14-10-;