(3-fluoranyl-4-methoxy-phenyl)methyl 2-(2-hydroxyethylamino)-5-nitro-benzoate

Systemtic Name: (3-fluoranyl-4-methoxy-phenyl)methyl 2-(2-hydroxyethylamino)-5-nitro-benzoate Openeye Name: (3-fluoro-4-methoxy-phenyl)methyl 2-(2-hydroxyethylamino)-5-nitro-benzoate CAS Name: 2-(2-hydroxyethylamino)-5-nitrobenzoic acid (3-fluoro-4-methoxyphenyl)methyl ester IUPAC Name: (3-fluoro-4-methoxyphenyl)methyl 2-(2-hydroxyethylamino)-5-nitrobenzoate Traditional Name: 2-(2-hydroxyethylamino)-5-nitro-benzoic acid (3-fluoro-4-methoxy-benzyl) ester Formula: C17H17FN2O6 MolecularWeight: 364.325083

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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-])NCCO)F

Isomeric SMILES

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

InChI

InChI=1S/C17H17FN2O6/c1-25-16-5-2-11(8-14(16)18)10-26-17(22)13-9-12(20(23)24)3-4-15(13)19-6-7-21/h2-5,8-9,19,21H,6-7,10H2,1H3