methyl 3-nitro-4-[2-oxidanylidene-2-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)ethoxy]benzoate

Systemtic Name: methyl 3-nitro-4-[2-oxidanylidene-2-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)ethoxy]benzoate Openeye Name: methyl 3-nitro-4-[2-oxo-2-(3-oxo-4H-1,4-benzoxazin-6-yl)ethoxy]benzoate CAS Name: 3-nitro-4-[2-oxo-2-(3-oxo-4H-1,4-benzoxazin-6-yl)ethoxy]benzoic acid methyl ester IUPAC Name: methyl 3-nitro-4-[2-oxo-2-(3-oxo-4H-1,4-benzoxazin-6-yl)ethoxy]benzoate Traditional Name: 4-[2-keto-2-(3-keto-4H-1,4-benzoxazin-6-yl)ethoxy]-3-nitro-benzoic acid methyl ester Formula: C18H14N2O8 MolecularWeight: 386.31236

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)OCC(=O)C2=CC3=C(C=C2)OCC(=O)N3)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)OCC(=O)C2=CC3=C(C=C2)OCC(=O)N3)[N+](=O)[O-]

InChI

InChI=1S/C18H14N2O8/c1-26-18(23)11-3-5-16(13(7-11)20(24)25)27-8-14(21)10-2-4-15-12(6-10)19-17(22)9-28-15/h2-7H,8-9H2,1H3,(H,19,22)