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

Systemtic Name: O3-[2-(4-fluorophenyl)-2-oxidanylidene-ethyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O3-[2-(4-fluorophenyl)-2-oxo-ethyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-(4-fluorophenyl)-2-oxoethyl] ester O1-methyl ester IUPAC Name: 3-O-[2-(4-fluorophenyl)-2-oxoethyl] 1-O-methyl 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-(4-fluorophenyl)-2-keto-ethyl] ester O1-methyl ester Formula: C17H12FNO7 MolecularWeight: 361.278083

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCC(=O)C2=CC=C(C=C2)F

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCC(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C17H12FNO7/c1-25-16(21)11-6-12(8-14(7-11)19(23)24)17(22)26-9-15(20)10-2-4-13(18)5-3-10/h2-8H,9H2,1H3