(4-bromanyl-2-fluoranyl-phenyl)methyl 4-azanyl-3-nitro-benzoate

Systemtic Name: (4-bromanyl-2-fluoranyl-phenyl)methyl 4-azanyl-3-nitro-benzoate Openeye Name: (4-bromo-2-fluoro-phenyl)methyl 4-amino-3-nitro-benzoate CAS Name: 4-amino-3-nitrobenzoic acid (4-bromo-2-fluorophenyl)methyl ester IUPAC Name: (4-bromo-2-fluorophenyl)methyl 4-amino-3-nitrobenzoate Traditional Name: 4-amino-3-nitro-benzoic acid (4-bromo-2-fluoro-benzyl) ester Formula: C14H10BrFN2O4 MolecularWeight: 369.142603

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)OCC2=C(C=C(C=C2)Br)F)[N+](=O)[O-])N

Isomeric SMILES

C1=CC(=C(C=C1C(=O)OCC2=C(C=C(C=C2)Br)F)[N+](=O)[O-])N

InChI

InChI=1S/C14H10BrFN2O4/c15-10-3-1-9(11(16)6-10)7-22-14(19)8-2-4-12(17)13(5-8)18(20)21/h1-6H,7,17H2