(3-fluorophenyl)methyl 2-(6-nitro-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoate

Systemtic Name: (3-fluorophenyl)methyl 2-(6-nitro-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoate Openeye Name: (3-fluorophenyl)methyl 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 (3-fluorophenyl)methyl ester IUPAC Name: (3-fluorophenyl)methyl 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 (3-fluorobenzyl) ester Formula: C17H13FN2O6 MolecularWeight: 360.293323

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=C(O1)C=CC(=C2)[N+](=O)[O-])CC(=O)OCC3=CC(=CC=C3)F

Isomeric SMILES

C1C(=O)N(C2=C(O1)C=CC(=C2)[N+](=O)[O-])CC(=O)OCC3=CC(=CC=C3)F

InChI

InChI=1S/C17H13FN2O6/c18-12-3-1-2-11(6-12)9-26-17(22)8-19-14-7-13(20(23)24)4-5-15(14)25-10-16(19)21/h1-7H,8-10H2