O1-ethyl O3-[1-[(3-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl] 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O1-ethyl O3-[1-[(3-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl] 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O1-ethyl O3-[1-methyl-2-(3-nitroanilino)-2-oxo-ethyl] 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-ethyl ester O3-[1-(3-nitroanilino)-1-oxopropan-2-yl] ester IUPAC Name: 1-O-ethyl 3-O-[1-(3-nitroanilino)-1-oxopropan-2-yl] 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-ethyl ester O3-[2-keto-1-methyl-2-(3-nitroanilino)ethyl] ester Formula: C19H17N3O9 MolecularWeight: 431.35298

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OC(C)C(=O)NC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OC(C)C(=O)NC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C19H17N3O9/c1-3-30-18(24)12-7-13(9-16(8-12)22(28)29)19(25)31-11(2)17(23)20-14-5-4-6-15(10-14)21(26)27/h4-11H,3H2,1-2H3,(H,20,23)