methyl 3-[[2-(2-fluoranylphenoxy)propanoylamino]carbamoyl]-5-nitro-benzoate

Systemtic Name: methyl 3-[[2-(2-fluoranylphenoxy)propanoylamino]carbamoyl]-5-nitro-benzoate Openeye Name: methyl 3-[[2-(2-fluorophenoxy)propanoylamino]carbamoyl]-5-nitro-benzoate CAS Name: 3-[[[2-(2-fluorophenoxy)-1-oxopropyl]hydrazo]-oxomethyl]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-[[2-(2-fluorophenoxy)propanoylamino]carbamoyl]-5-nitrobenzoate Traditional Name: 3-[[2-(2-fluorophenoxy)propanoylamino]carbamoyl]-5-nitro-benzoic acid methyl ester Formula: C18H16FN3O7 MolecularWeight: 405.333943

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NNC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OC)OC2=CC=CC=C2F

Isomeric SMILES

CC(C(=O)NNC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OC)OC2=CC=CC=C2F

InChI

InChI=1S/C18H16FN3O7/c1-10(29-15-6-4-3-5-14(15)19)16(23)20-21-17(24)11-7-12(18(25)28-2)9-13(8-11)22(26)27/h3-10H,1-2H3,(H,20,23)(H,21,24)