(4-fluorophenyl)methyl 2-(2-methoxyethylamino)-5-nitro-benzoate

Systemtic Name: (4-fluorophenyl)methyl 2-(2-methoxyethylamino)-5-nitro-benzoate Openeye Name: (4-fluorophenyl)methyl 2-(2-methoxyethylamino)-5-nitro-benzoate CAS Name: 2-(2-methoxyethylamino)-5-nitrobenzoic acid (4-fluorophenyl)methyl ester IUPAC Name: (4-fluorophenyl)methyl 2-(2-methoxyethylamino)-5-nitrobenzoate Traditional Name: 2-(2-methoxyethylamino)-5-nitro-benzoic acid (4-fluorobenzyl) ester Formula: C17H17FN2O5 MolecularWeight: 348.325683

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17FN2O5/c1-24-9-8-19-16-7-6-14(20(22)23)10-15(16)17(21)25-11-12-2-4-13(18)5-3-12/h2-7,10,19H,8-9,11H2,1H3