N-(7-nitro-3-oxidanylidene-4H-1,4-benzoxazin-6-yl)-2-[4-(phenylcarbonyl)phenoxy]ethanamide

Systemtic Name: N-(7-nitro-3-oxidanylidene-4H-1,4-benzoxazin-6-yl)-2-[4-(phenylcarbonyl)phenoxy]ethanamide Openeye Name: 2-(4-benzoylphenoxy)-N-(7-nitro-3-oxo-4H-1,4-benzoxazin-6-yl)acetamide CAS Name: 2-(4-benzoylphenoxy)-N-(7-nitro-3-oxo-4H-1,4-benzoxazin-6-yl)acetamide IUPAC Name: 2-(4-benzoylphenoxy)-N-(7-nitro-3-oxo-4H-1,4-benzoxazin-6-yl)acetamide Traditional Name: 2-(4-benzoylphenoxy)-N-(3-keto-7-nitro-4H-1,4-benzoxazin-6-yl)acetamide Formula: C23H17N3O7 MolecularWeight: 447.39698

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=CC(=C(C=C2O1)[N+](=O)[O-])NC(=O)COC3=CC=C(C=C3)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1C(=O)NC2=CC(=C(C=C2O1)[N+](=O)[O-])NC(=O)COC3=CC=C(C=C3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H17N3O7/c27-21(24-17-10-18-20(11-19(17)26(30)31)33-13-22(28)25-18)12-32-16-8-6-15(7-9-16)23(29)14-4-2-1-3-5-14/h1-11H,12-13H2,(H,24,27)(H,25,28)