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

Systemtic Name: 3,5-dinitro-N-[3-(4-oxidanylidene-3,1-benzoxazin-2-yl)phenyl]benzamide Openeye Name: 3,5-dinitro-N-[3-(4-oxo-3,1-benzoxazin-2-yl)phenyl]benzamide CAS Name: 3,5-dinitro-N-[3-(4-oxo-3,1-benzoxazin-2-yl)phenyl]benzamide IUPAC Name: 3,5-dinitro-N-[3-(4-oxo-3,1-benzoxazin-2-yl)phenyl]benzamide Traditional Name: N-[3-(4-keto-3,1-benzoxazin-2-yl)phenyl]-3,5-dinitro-benzamide Formula: C21H12N4O7 MolecularWeight: 432.34258

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H12N4O7/c26-19(13-9-15(24(28)29)11-16(10-13)25(30)31)22-14-5-3-4-12(8-14)20-23-18-7-2-1-6-17(18)21(27)32-20/h1-11H,(H,22,26)