(2-chloranyl-6-fluoranyl-phenyl)methyl 2-[(4-methoxy-3-nitro-phenyl)carbonylamino]ethanoate

Systemtic Name: (2-chloranyl-6-fluoranyl-phenyl)methyl 2-[(4-methoxy-3-nitro-phenyl)carbonylamino]ethanoate Openeye Name: (2-chloro-6-fluoro-phenyl)methyl 2-[(4-methoxy-3-nitro-benzoyl)amino]acetate CAS Name: 2-[[(4-methoxy-3-nitrophenyl)-oxomethyl]amino]acetic acid (2-chloro-6-fluorophenyl)methyl ester IUPAC Name: (2-chloro-6-fluorophenyl)methyl 2-[(4-methoxy-3-nitrobenzoyl)amino]acetate Traditional Name: 2-[(4-methoxy-3-nitro-benzoyl)amino]acetic acid (2-chloro-6-fluoro-benzyl) ester Formula: C17H14ClFN2O6 MolecularWeight: 396.754263

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NCC(=O)OCC2=C(C=CC=C2Cl)F)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NCC(=O)OCC2=C(C=CC=C2Cl)F)[N+](=O)[O-]

InChI

InChI=1S/C17H14ClFN2O6/c1-26-15-6-5-10(7-14(15)21(24)25)17(23)20-8-16(22)27-9-11-12(18)3-2-4-13(11)19/h2-7H,8-9H2,1H3,(H,20,23)