dimethyl 5-[2-(2,4-dinitrophenyl)ethanoylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[2-(2,4-dinitrophenyl)ethanoylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[2-(2,4-dinitrophenyl)acetyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[2-(2,4-dinitrophenyl)-1-oxoethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[2-(2,4-dinitrophenyl)acetyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[2-(2,4-dinitrophenyl)acetyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C18H15N3O9 MolecularWeight: 417.3264

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)CC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)CC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C18H15N3O9/c1-29-17(23)11-5-12(18(24)30-2)7-13(6-11)19-16(22)8-10-3-4-14(20(25)26)9-15(10)21(27)28/h3-7,9H,8H2,1-2H3,(H,19,22)