2-(pyridin-1-ium-1-ylmethyl)-1H-quinazolin-4-one iodide

Systemtic Name: 2-(pyridin-1-ium-1-ylmethyl)-1H-quinazolin-4-one iodide Openeye Name: 2-(pyridin-1-ium-1-ylmethyl)-1H-quinazolin-4-one iodide CAS Name: 2-(1-pyridin-1-iumylmethyl)-1H-quinazolin-4-one iodide IUPAC Name: 2-(pyridin-1-ium-1-ylmethyl)-1H-quinazolin-4-one iodide Traditional Name: 2-(pyridin-1-ium-1-ylmethyl)-1H-quinazolin-4-one iodide Formula: C14H12IN3O MolecularWeight: 365.16905

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C=C1)CC2=NC(=O)C3=CC=CC=C3N2.[I-]

Isomeric SMILES

C1=CC=[N+](C=C1)CC2=NC(=O)C3=CC=CC=C3N2.[I-]

InChI

InChI=1S/C14H11N3O.HI/c18-14-11-6-2-3-7-12(11)15-13(16-14)10-17-8-4-1-5-9-17;/h1-9H,10H2;1H