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

Systemtic Name: 2-(pyridin-1-ium-1-ylmethyl)-1H-quinazolin-4-one chloride Openeye Name: 2-(pyridin-1-ium-1-ylmethyl)-1H-quinazolin-4-one chloride CAS Name: 2-(1-pyridin-1-iumylmethyl)-1H-quinazolin-4-one chloride IUPAC Name: 2-(pyridin-1-ium-1-ylmethyl)-1H-quinazolin-4-one chloride Traditional Name: 2-(pyridin-1-ium-1-ylmethyl)-1H-quinazolin-4-one chloride Formula: C14H12ClN3O MolecularWeight: 273.71758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H11N3O.ClH/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