(2-chloranyl-4-fluoranyl-phenyl)methyl 2-[(4-chloranyl-3-nitro-phenyl)carbonylamino]ethanoate

Systemtic Name: (2-chloranyl-4-fluoranyl-phenyl)methyl 2-[(4-chloranyl-3-nitro-phenyl)carbonylamino]ethanoate Openeye Name: (2-chloro-4-fluoro-phenyl)methyl 2-[(4-chloro-3-nitro-benzoyl)amino]acetate CAS Name: 2-[[(4-chloro-3-nitrophenyl)-oxomethyl]amino]acetic acid (2-chloro-4-fluorophenyl)methyl ester IUPAC Name: (2-chloro-4-fluorophenyl)methyl 2-[(4-chloro-3-nitrobenzoyl)amino]acetate Traditional Name: 2-[(4-chloro-3-nitro-benzoyl)amino]acetic acid (2-chloro-4-fluoro-benzyl) ester Formula: C16H11Cl2FN2O5 MolecularWeight: 401.173343

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H11Cl2FN2O5/c17-12-4-2-9(5-14(12)21(24)25)16(23)20-7-15(22)26-8-10-1-3-11(19)6-13(10)18/h1-6H,7-8H2,(H,20,23)