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

Systemtic Name: O3-[2-(2,4-dichlorophenyl)-2-oxidanylidene-ethyl] O1-ethyl 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O3-[2-(2,4-dichlorophenyl)-2-oxo-ethyl] O1-ethyl 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-(2,4-dichlorophenyl)-2-oxoethyl] ester O1-ethyl ester IUPAC Name: 3-O-[2-(2,4-dichlorophenyl)-2-oxoethyl] 1-O-ethyl 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-(2,4-dichlorophenyl)-2-keto-ethyl] ester O1-ethyl ester Formula: C18H13Cl2NO7 MolecularWeight: 426.20432

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H13Cl2NO7/c1-2-27-17(23)10-5-11(7-13(6-10)21(25)26)18(24)28-9-16(22)14-4-3-12(19)8-15(14)20/h3-8H,2,9H2,1H3