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

Systemtic Name: methyl 5-[[4-(4-chloranyl-2-nitro-phenoxy)-3-methoxy-phenyl]carbonylamino]-2-fluoranyl-benzoate Openeye Name: methyl 5-[[4-(4-chloro-2-nitro-phenoxy)-3-methoxy-benzoyl]amino]-2-fluoro-benzoate CAS Name: 5-[[[4-(4-chloro-2-nitrophenoxy)-3-methoxyphenyl]-oxomethyl]amino]-2-fluorobenzoic acid methyl ester IUPAC Name: methyl 5-[[4-(4-chloro-2-nitrophenoxy)-3-methoxybenzoyl]amino]-2-fluorobenzoate Traditional Name: 5-[[4-(4-chloro-2-nitro-phenoxy)-3-methoxy-benzoyl]amino]-2-fluoro-benzoic acid methyl ester Formula: C22H16ClFN2O7 MolecularWeight: 474.823043

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)NC2=CC(=C(C=C2)F)C(=O)OC)OC3=C(C=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)NC2=CC(=C(C=C2)F)C(=O)OC)OC3=C(C=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C22H16ClFN2O7/c1-31-20-9-12(21(27)25-14-5-6-16(24)15(11-14)22(28)32-2)3-7-19(20)33-18-8-4-13(23)10-17(18)26(29)30/h3-11H,1-2H3,(H,25,27)