[4-(4-fluorophenyl)carbonylphenyl] 2-(6-nitro-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoate

Systemtic Name: [4-(4-fluorophenyl)carbonylphenyl] 2-(6-nitro-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoate Openeye Name: [4-(4-fluorobenzoyl)phenyl] 2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetate CAS Name: 2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetic acid [4-[(4-fluorophenyl)-oxomethyl]phenyl] ester IUPAC Name: [4-(4-fluorobenzoyl)phenyl] 2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetate Traditional Name: 2-(3-keto-6-nitro-1,4-benzoxazin-4-yl)acetic acid [4-(4-fluorobenzoyl)phenyl] ester Formula: C23H15FN2O7 MolecularWeight: 450.372803

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=C(O1)C=CC(=C2)[N+](=O)[O-])CC(=O)OC3=CC=C(C=C3)C(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1C(=O)N(C2=C(O1)C=CC(=C2)[N+](=O)[O-])CC(=O)OC3=CC=C(C=C3)C(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H15FN2O7/c24-16-5-1-14(2-6-16)23(29)15-3-8-18(9-4-15)33-22(28)12-25-19-11-17(26(30)31)7-10-20(19)32-13-21(25)27/h1-11H,12-13H2