[3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]methylazanium chloride

Systemtic Name: [3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]methylazanium chloride Openeye Name: [4-oxo-3-(p-tolyl)quinazolin-2-yl]methylammonium chloride CAS Name: [3-(4-methylphenyl)-4-oxo-2-quinazolinyl]methylammonium chloride IUPAC Name: [3-(4-methylphenyl)-4-oxoquinazolin-2-yl]methylazanium chloride Traditional Name: [4-keto-3-(p-tolyl)quinazolin-2-yl]methylammonium chloride Formula: C16H16ClN3O MolecularWeight: 301.77074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NC3=CC=CC=C3C2=O)C[NH3+].[Cl-]

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NC3=CC=CC=C3C2=O)C[NH3+].[Cl-]

InChI

InChI=1S/C16H15N3O.ClH/c1-11-6-8-12(9-7-11)19-15(10-17)18-14-5-3-2-4-13(14)16(19)20;/h2-9H,10,17H2,1H3;1H