3-[4,5-bis(fluoranyl)-2-nitro-phenyl]-3-oxidanylidene-propanoic acid

Systemtic Name: 3-[4,5-bis(fluoranyl)-2-nitro-phenyl]-3-oxidanylidene-propanoic acid Openeye Name: 3-(4,5-difluoro-2-nitro-phenyl)-3-oxo-propanoic acid CAS Name: 3-(4,5-difluoro-2-nitrophenyl)-3-oxopropanoic acid IUPAC Name: 3-(4,5-difluoro-2-nitrophenyl)-3-oxopropanoic acid Traditional Name: 3-(4,5-difluoro-2-nitro-phenyl)-3-keto-propionic acid Formula: C9H5F2NO5 MolecularWeight: 245.136506

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=CC(=C1F)F)[N+](=O)[O-])C(=O)CC(=O)O

Isomeric SMILES

C1=C(C(=CC(=C1F)F)[N+](=O)[O-])C(=O)CC(=O)O

InChI

InChI=1S/C9H5F2NO5/c10-5-1-4(8(13)3-9(14)15)7(12(16)17)2-6(5)11/h1-2H,3H2,(H,14,15)