2-[4-cyano-5-fluoranyl-2-[(3-nitrophenyl)methylcarbamoyl]phenoxy]ethanoic acid

Systemtic Name: 2-[4-cyano-5-fluoranyl-2-[(3-nitrophenyl)methylcarbamoyl]phenoxy]ethanoic acid Openeye Name: 2-[4-cyano-5-fluoro-2-[(3-nitrophenyl)methylcarbamoyl]phenoxy]acetic acid CAS Name: 2-[4-cyano-5-fluoro-2-[[(3-nitrophenyl)methylamino]-oxomethyl]phenoxy]acetic acid IUPAC Name: 2-[4-cyano-5-fluoro-2-[(3-nitrophenyl)methylcarbamoyl]phenoxy]acetic acid Traditional Name: 2-[4-cyano-5-fluoro-2-[(3-nitrobenzyl)carbamoyl]phenoxy]acetic acid Formula: C17H12FN3O6 MolecularWeight: 373.292083

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H12FN3O6/c18-14-6-15(27-9-16(22)23)13(5-11(14)7-19)17(24)20-8-10-2-1-3-12(4-10)21(25)26/h1-6H,8-9H2,(H,20,24)(H,22,23)