2-[5-fluoranyl-2-nitro-3-[(phenylmethyl)carbamoyl]phenoxy]ethanoic acid

Systemtic Name: 2-[5-fluoranyl-2-nitro-3-[(phenylmethyl)carbamoyl]phenoxy]ethanoic acid Openeye Name: 2-[3-(benzylcarbamoyl)-5-fluoro-2-nitro-phenoxy]acetic acid CAS Name: 2-[5-fluoro-2-nitro-3-[oxo-[(phenylmethyl)amino]methyl]phenoxy]acetic acid IUPAC Name: 2-[3-(benzylcarbamoyl)-5-fluoro-2-nitrophenoxy]acetic acid Traditional Name: 2-[3-(benzylcarbamoyl)-5-fluoro-2-nitro-phenoxy]acetic acid Formula: C16H13FN2O6 MolecularWeight: 348.282623

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C2=CC(=CC(=C2[N+](=O)[O-])OCC(=O)O)F

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)C2=CC(=CC(=C2[N+](=O)[O-])OCC(=O)O)F

InChI

InChI=1S/C16H13FN2O6/c17-11-6-12(16(22)18-8-10-4-2-1-3-5-10)15(19(23)24)13(7-11)25-9-14(20)21/h1-7H,8-9H2,(H,18,22)(H,20,21)