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

Systemtic Name: O1-ethyl O3-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O1-ethyl O3-[2-(4-fluoroanilino)-2-oxo-1-phenyl-ethyl] 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-ethyl ester O3-[2-(4-fluoroanilino)-2-oxo-1-phenylethyl] ester IUPAC Name: 1-O-ethyl 3-O-[2-(4-fluoroanilino)-2-oxo-1-phenylethyl] 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-ethyl ester O3-[2-(4-fluoroanilino)-2-keto-1-phenyl-ethyl] ester Formula: C24H19FN2O7 MolecularWeight: 466.415263

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OC(C2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OC(C2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C24H19FN2O7/c1-2-33-23(29)16-12-17(14-20(13-16)27(31)32)24(30)34-21(15-6-4-3-5-7-15)22(28)26-19-10-8-18(25)9-11-19/h3-14,21H,2H2,1H3,(H,26,28)