methyl 5-[(3-ethoxycarbonyl-5-nitro-phenyl)carbonylamino]-2,4-bis(fluoranyl)benzoate

Systemtic Name: methyl 5-[(3-ethoxycarbonyl-5-nitro-phenyl)carbonylamino]-2,4-bis(fluoranyl)benzoate Openeye Name: methyl 5-[(3-ethoxycarbonyl-5-nitro-benzoyl)amino]-2,4-difluoro-benzoate CAS Name: 5-[[(3-ethoxycarbonyl-5-nitrophenyl)-oxomethyl]amino]-2,4-difluorobenzoic acid methyl ester IUPAC Name: methyl 5-[(3-ethoxycarbonyl-5-nitrobenzoyl)amino]-2,4-difluorobenzoate Traditional Name: 5-[(3-carbethoxy-5-nitro-benzoyl)amino]-2,4-difluoro-benzoic acid methyl ester Formula: C18H14F2N2O7 MolecularWeight: 408.309766

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)NC2=C(C=C(C(=C2)C(=O)OC)F)F)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)NC2=C(C=C(C(=C2)C(=O)OC)F)F)[N+](=O)[O-]

InChI

InChI=1S/C18H14F2N2O7/c1-3-29-17(24)10-4-9(5-11(6-10)22(26)27)16(23)21-15-7-12(18(25)28-2)13(19)8-14(15)20/h4-8H,3H2,1-2H3,(H,21,23)