(2-azanyl-2-oxidanylidene-ethyl) 5-(4-bromanyl-2-fluoranyl-phenoxy)-2-nitro-benzoate

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) 5-(4-bromanyl-2-fluoranyl-phenoxy)-2-nitro-benzoate Openeye Name: (2-amino-2-oxo-ethyl) 5-(4-bromo-2-fluoro-phenoxy)-2-nitro-benzoate CAS Name: 5-(4-bromo-2-fluorophenoxy)-2-nitrobenzoic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) 5-(4-bromo-2-fluorophenoxy)-2-nitrobenzoate Traditional Name: 5-(4-bromo-2-fluoro-phenoxy)-2-nitro-benzoic acid (2-amino-2-keto-ethyl) ester Formula: C15H10BrFN2O6 MolecularWeight: 413.152103

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1OC2=C(C=C(C=C2)Br)F)C(=O)OCC(=O)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1OC2=C(C=C(C=C2)Br)F)C(=O)OCC(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C15H10BrFN2O6/c16-8-1-4-13(11(17)5-8)25-9-2-3-12(19(22)23)10(6-9)15(21)24-7-14(18)20/h1-6H,7H2,(H2,18,20)