O3-[(2-chloranyl-6-fluoranyl-phenyl)methyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O3-[(2-chloranyl-6-fluoranyl-phenyl)methyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O3-[(2-chloro-6-fluoro-phenyl)methyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[(2-chloro-6-fluorophenyl)methyl] ester O1-methyl ester IUPAC Name: 3-O-[(2-chloro-6-fluorophenyl)methyl] 1-O-methyl 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-(2-chloro-6-fluoro-benzyl) ester O1-methyl ester Formula: C16H11ClFNO6 MolecularWeight: 367.713043

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCC2=C(C=CC=C2Cl)F

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCC2=C(C=CC=C2Cl)F

InChI

InChI=1S/C16H11ClFNO6/c1-24-15(20)9-5-10(7-11(6-9)19(22)23)16(21)25-8-12-13(17)3-2-4-14(12)18/h2-7H,8H2,1H3