O3-[2-[(3-chloranyl-4-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl] O1-ethyl 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O3-[2-[(3-chloranyl-4-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl] O1-ethyl 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O3-[2-(3-chloro-4-fluoro-anilino)-2-oxo-ethyl] O1-ethyl 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-(3-chloro-4-fluoroanilino)-2-oxoethyl] ester O1-ethyl ester IUPAC Name: 3-O-[2-(3-chloro-4-fluoroanilino)-2-oxoethyl] 1-O-ethyl 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-(3-chloro-4-fluoro-anilino)-2-keto-ethyl] ester O1-ethyl ester Formula: C18H14ClFN2O7 MolecularWeight: 424.764363

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H14ClFN2O7/c1-2-28-17(24)10-5-11(7-13(6-10)22(26)27)18(25)29-9-16(23)21-12-3-4-15(20)14(19)8-12/h3-8H,2,9H2,1H3,(H,21,23)