[4-[bis(fluoranyl)methoxy]-5-methoxy-2-nitro-phenyl]methyl 2-morpholin-4-yl-5-nitro-benzoate

Systemtic Name: [4-[bis(fluoranyl)methoxy]-5-methoxy-2-nitro-phenyl]methyl 2-morpholin-4-yl-5-nitro-benzoate Openeye Name: [4-(difluoromethoxy)-5-methoxy-2-nitro-phenyl]methyl 2-morpholino-5-nitro-benzoate CAS Name: 2-(4-morpholinyl)-5-nitrobenzoic acid [4-(difluoromethoxy)-5-methoxy-2-nitrophenyl]methyl ester IUPAC Name: [4-(difluoromethoxy)-5-methoxy-2-nitrophenyl]methyl 2-morpholin-4-yl-5-nitrobenzoate Traditional Name: 2-morpholino-5-nitro-benzoic acid [4-(difluoromethoxy)-5-methoxy-2-nitro-benzyl] ester Formula: C20H19F2N3O9 MolecularWeight: 483.376366

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)COC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCOCC3)[N+](=O)[O-])OC(F)F

Isomeric SMILES

COC1=C(C=C(C(=C1)COC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCOCC3)[N+](=O)[O-])OC(F)F

InChI

InChI=1S/C20H19F2N3O9/c1-31-17-8-12(16(25(29)30)10-18(17)34-20(21)22)11-33-19(26)14-9-13(24(27)28)2-3-15(14)23-4-6-32-7-5-23/h2-3,8-10,20H,4-7,11H2,1H3