(5-fluoranyl-2-methoxy-phenyl)methyl 2-(2-methoxyethylamino)-5-nitro-benzoate

Systemtic Name: (5-fluoranyl-2-methoxy-phenyl)methyl 2-(2-methoxyethylamino)-5-nitro-benzoate Openeye Name: (5-fluoro-2-methoxy-phenyl)methyl 2-(2-methoxyethylamino)-5-nitro-benzoate CAS Name: 2-(2-methoxyethylamino)-5-nitrobenzoic acid (5-fluoro-2-methoxyphenyl)methyl ester IUPAC Name: (5-fluoro-2-methoxyphenyl)methyl 2-(2-methoxyethylamino)-5-nitrobenzoate Traditional Name: 2-(2-methoxyethylamino)-5-nitro-benzoic acid (5-fluoro-2-methoxy-benzyl) ester Formula: C18H19FN2O6 MolecularWeight: 378.351663

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OCC2=C(C=CC(=C2)F)OC

Isomeric SMILES

COCCNC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OCC2=C(C=CC(=C2)F)OC

InChI

InChI=1S/C18H19FN2O6/c1-25-8-7-20-16-5-4-14(21(23)24)10-15(16)18(22)27-11-12-9-13(19)3-6-17(12)26-2/h3-6,9-10,20H,7-8,11H2,1-2H3