3,5-dinitro-N-(4-oxidanylidene-2-phenyl-quinazolin-3-yl)benzamide

Systemtic Name: 3,5-dinitro-N-(4-oxidanylidene-2-phenyl-quinazolin-3-yl)benzamide Openeye Name: 3,5-dinitro-N-(4-oxo-2-phenyl-quinazolin-3-yl)benzamide CAS Name: 3,5-dinitro-N-(4-oxo-2-phenyl-3-quinazolinyl)benzamide IUPAC Name: 3,5-dinitro-N-(4-oxo-2-phenylquinazolin-3-yl)benzamide Traditional Name: N-(4-keto-2-phenyl-quinazolin-3-yl)-3,5-dinitro-benzamide Formula: C21H13N5O6 MolecularWeight: 431.35782

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=O)N2NC(=O)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=O)N2NC(=O)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C21H13N5O6/c27-20(14-10-15(25(29)30)12-16(11-14)26(31)32)23-24-19(13-6-2-1-3-7-13)22-18-9-5-4-8-17(18)21(24)28/h1-12H,(H,23,27)