O3-[1-[(2,4-dichlorophenyl)amino]-1-oxidanylidene-propan-2-yl] O1-ethyl 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O3-[1-[(2,4-dichlorophenyl)amino]-1-oxidanylidene-propan-2-yl] O1-ethyl 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O3-[2-(2,4-dichloroanilino)-1-methyl-2-oxo-ethyl] O1-ethyl 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[1-(2,4-dichloroanilino)-1-oxopropan-2-yl] ester O1-ethyl ester IUPAC Name: 3-O-[1-(2,4-dichloroanilino)-1-oxopropan-2-yl] 1-O-ethyl 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-(2,4-dichloroanilino)-2-keto-1-methyl-ethyl] ester O1-ethyl ester Formula: C19H16Cl2N2O7 MolecularWeight: 455.24554

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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=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

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

InChI

InChI=1S/C19H16Cl2N2O7/c1-3-29-18(25)11-6-12(8-14(7-11)23(27)28)19(26)30-10(2)17(24)22-16-5-4-13(20)9-15(16)21/h4-10H,3H2,1-2H3,(H,22,24)