methyl 3-[(5-ethoxy-4-methoxy-2-nitro-phenyl)carbonylamino]-4-fluoranyl-benzoate

Systemtic Name: methyl 3-[(5-ethoxy-4-methoxy-2-nitro-phenyl)carbonylamino]-4-fluoranyl-benzoate Openeye Name: methyl 3-[(5-ethoxy-4-methoxy-2-nitro-benzoyl)amino]-4-fluoro-benzoate CAS Name: 3-[[(5-ethoxy-4-methoxy-2-nitrophenyl)-oxomethyl]amino]-4-fluorobenzoic acid methyl ester IUPAC Name: methyl 3-[(5-ethoxy-4-methoxy-2-nitrobenzoyl)amino]-4-fluorobenzoate Traditional Name: 3-[(5-ethoxy-4-methoxy-2-nitro-benzoyl)amino]-4-fluoro-benzoic acid methyl ester Formula: C18H17FN2O7 MolecularWeight: 392.335183

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C(=O)NC2=C(C=CC(=C2)C(=O)OC)F)[N+](=O)[O-])OC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)C(=O)NC2=C(C=CC(=C2)C(=O)OC)F)[N+](=O)[O-])OC

InChI

InChI=1S/C18H17FN2O7/c1-4-28-16-8-11(14(21(24)25)9-15(16)26-2)17(22)20-13-7-10(18(23)27-3)5-6-12(13)19/h5-9H,4H2,1-3H3,(H,20,22)