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

Systemtic Name: (3-fluoranyl-4-methoxy-phenyl)methyl 2-(methylamino)-5-nitro-benzoate Openeye Name: (3-fluoro-4-methoxy-phenyl)methyl 2-(methylamino)-5-nitro-benzoate CAS Name: 2-(methylamino)-5-nitrobenzoic acid (3-fluoro-4-methoxyphenyl)methyl ester IUPAC Name: (3-fluoro-4-methoxyphenyl)methyl 2-(methylamino)-5-nitrobenzoate Traditional Name: 2-(methylamino)-5-nitro-benzoic acid (3-fluoro-4-methoxy-benzyl) ester Formula: C16H15FN2O5 MolecularWeight: 334.299103

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OCC2=CC(=C(C=C2)OC)F

Isomeric SMILES

CNC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OCC2=CC(=C(C=C2)OC)F

InChI

InChI=1S/C16H15FN2O5/c1-18-14-5-4-11(19(21)22)8-12(14)16(20)24-9-10-3-6-15(23-2)13(17)7-10/h3-8,18H,9H2,1-2H3