dimethyl-[1-(4-oxidanylidenequinazolin-3-yl)pentan-3-yl]azanium iodide

Systemtic Name: dimethyl-[1-(4-oxidanylidenequinazolin-3-yl)pentan-3-yl]azanium iodide Openeye Name: [1-ethyl-3-(4-oxoquinazolin-3-yl)propyl]-dimethyl-ammonium iodide CAS Name: dimethyl-[1-(4-oxo-3-quinazolinyl)pentan-3-yl]ammonium iodide IUPAC Name: dimethyl-[1-(4-oxoquinazolin-3-yl)pentan-3-yl]azanium iodide Traditional Name: [1-ethyl-3-(4-ketoquinazolin-3-yl)propyl]-dimethyl-ammonium iodide Formula: C15H22IN3O MolecularWeight: 387.25915

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCN1C=NC2=CC=CC=C2C1=O)[NH+](C)C.[I-]

Isomeric SMILES

CCC(CCN1C=NC2=CC=CC=C2C1=O)[NH+](C)C.[I-]

InChI

InChI=1S/C15H21N3O.HI/c1-4-12(17(2)3)9-10-18-11-16-14-8-6-5-7-13(14)15(18)19;/h5-8,11-12H,4,9-10H2,1-3H3;1H