dimethyl 2-[2-(5-fluoranyl-2-nitro-phenoxy)ethanoylamino]benzene-1,4-dicarboxylate

Systemtic Name: dimethyl 2-[2-(5-fluoranyl-2-nitro-phenoxy)ethanoylamino]benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-[[2-(5-fluoro-2-nitro-phenoxy)acetyl]amino]benzene-1,4-dicarboxylate CAS Name: 2-[[2-(5-fluoro-2-nitrophenoxy)-1-oxoethyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[[2-(5-fluoro-2-nitrophenoxy)acetyl]amino]benzene-1,4-dicarboxylate Traditional Name: 2-[[2-(5-fluoro-2-nitro-phenoxy)acetyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester Formula: C18H15FN2O8 MolecularWeight: 406.318703

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=O)COC2=C(C=CC(=C2)F)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=O)COC2=C(C=CC(=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C18H15FN2O8/c1-27-17(23)10-3-5-12(18(24)28-2)13(7-10)20-16(22)9-29-15-8-11(19)4-6-14(15)21(25)26/h3-8H,9H2,1-2H3,(H,20,22)