3,5-dinitro-N-[2-(4-oxidanylidene-1H-quinazolin-2-yl)phenyl]benzamide

Systemtic Name: 3,5-dinitro-N-[2-(4-oxidanylidene-1H-quinazolin-2-yl)phenyl]benzamide Openeye Name: 3,5-dinitro-N-[2-(4-oxo-1H-quinazolin-2-yl)phenyl]benzamide CAS Name: 3,5-dinitro-N-[2-(4-oxo-1H-quinazolin-2-yl)phenyl]benzamide IUPAC Name: 3,5-dinitro-N-[2-(4-oxo-1H-quinazolin-2-yl)phenyl]benzamide Traditional Name: N-[2-(4-keto-1H-quinazolin-2-yl)phenyl]-3,5-dinitro-benzamide Formula: C21H13N5O6 MolecularWeight: 431.35782

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N=C(N2)C3=CC=CC=C3NC(=O)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N=C(N2)C3=CC=CC=C3NC(=O)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

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