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

Systemtic Name: 2-[[(4-oxidanylidenequinazolin-3-yl)methylamino]methyl]isoindole-1,3-dione Openeye Name: 2-[[(4-oxoquinazolin-3-yl)methylamino]methyl]isoindoline-1,3-dione CAS Name: 2-[[(4-oxo-3-quinazolinyl)methylamino]methyl]isoindole-1,3-dione IUPAC Name: 2-[[(4-oxoquinazolin-3-yl)methylamino]methyl]isoindole-1,3-dione Traditional Name: 2-[[(4-ketoquinazolin-3-yl)methylamino]methyl]isoindoline-1,3-quinone Formula: C18H14N4O3 MolecularWeight: 334.32876

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CNCN3C=NC4=CC=CC=C4C3=O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CNCN3C=NC4=CC=CC=C4C3=O

InChI

InChI=1S/C18H14N4O3/c23-16-14-7-3-4-8-15(14)20-11-21(16)9-19-10-22-17(24)12-5-1-2-6-13(12)18(22)25/h1-8,11,19H,9-10H2