2-[(4-oxidanylidenequinazolin-3-yl)methyl]isoindole-1,3-dione dihydrochloride

Systemtic Name: 2-[(4-oxidanylidenequinazolin-3-yl)methyl]isoindole-1,3-dione dihydrochloride Openeye Name: 2-[(4-oxoquinazolin-3-yl)methyl]isoindoline-1,3-dione dihydrochloride CAS Name: 2-[(4-oxo-3-quinazolinyl)methyl]isoindole-1,3-dione dihydrochloride IUPAC Name: 2-[(4-oxoquinazolin-3-yl)methyl]isoindole-1,3-dione dihydrochloride Traditional Name: 2-[(4-ketoquinazolin-3-yl)methyl]isoindoline-1,3-quinone dihydrochloride Formula: C17H13Cl2N3O3 MolecularWeight: 378.20942

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CN3C=NC4=CC=CC=C4C3=O.Cl.Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CN3C=NC4=CC=CC=C4C3=O.Cl.Cl

InChI

InChI=1S/C17H11N3O3.2ClH/c21-15-13-7-3-4-8-14(13)18-9-19(15)10-20-16(22)11-5-1-2-6-12(11)17(20)23;;/h1-9H,10H2;2*1H