methyl 2-fluoranyl-6-[3-fluoranyl-4-[[(3-nitrophenyl)carbonylamino]methyl]phenyl]benzoate

Systemtic Name: methyl 2-fluoranyl-6-[3-fluoranyl-4-[[(3-nitrophenyl)carbonylamino]methyl]phenyl]benzoate Openeye Name: methyl 2-fluoro-6-[3-fluoro-4-[[(3-nitrobenzoyl)amino]methyl]phenyl]benzoate CAS Name: 2-fluoro-6-[3-fluoro-4-[[[(3-nitrophenyl)-oxomethyl]amino]methyl]phenyl]benzoic acid methyl ester IUPAC Name: methyl 2-fluoro-6-[3-fluoro-4-[[(3-nitrobenzoyl)amino]methyl]phenyl]benzoate Traditional Name: 2-fluoro-6-[3-fluoro-4-[[(3-nitrobenzoyl)amino]methyl]phenyl]benzoic acid methyl ester Formula: C22H16F2N2O5 MolecularWeight: 426.369646

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC=C1F)C2=CC(=C(C=C2)CNC(=O)C3=CC(=CC=C3)[N+](=O)[O-])F

Isomeric SMILES

COC(=O)C1=C(C=CC=C1F)C2=CC(=C(C=C2)CNC(=O)C3=CC(=CC=C3)[N+](=O)[O-])F

InChI

InChI=1S/C22H16F2N2O5/c1-31-22(28)20-17(6-3-7-18(20)23)13-8-9-15(19(24)11-13)12-25-21(27)14-4-2-5-16(10-14)26(29)30/h2-11H,12H2,1H3,(H,25,27)