O3-[3-(4-fluoranylphenoxy)propyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O3-[3-(4-fluoranylphenoxy)propyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O3-[3-(4-fluorophenoxy)propyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[3-(4-fluorophenoxy)propyl] ester O1-methyl ester IUPAC Name: 3-O-[3-(4-fluorophenoxy)propyl] 1-O-methyl 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[3-(4-fluorophenoxy)propyl] ester O1-methyl ester Formula: C18H16FNO7 MolecularWeight: 377.320543

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCCCOC2=CC=C(C=C2)F

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCCCOC2=CC=C(C=C2)F

InChI

InChI=1S/C18H16FNO7/c1-25-17(21)12-9-13(11-15(10-12)20(23)24)18(22)27-8-2-7-26-16-5-3-14(19)4-6-16/h3-6,9-11H,2,7-8H2,1H3