4-[2-(2-fluoranyl-4-nitro-phenyl)phenyl]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[2-(2-fluoranyl-4-nitro-phenyl)phenyl]-4-oxidanylidene-butanoic acid Openeye Name: 4-[2-(2-fluoro-4-nitro-phenyl)phenyl]-4-oxo-butanoic acid CAS Name: 4-[2-(2-fluoro-4-nitrophenyl)phenyl]-4-oxobutanoic acid IUPAC Name: 4-[2-(2-fluoro-4-nitrophenyl)phenyl]-4-oxobutanoic acid Traditional Name: 4-[2-(2-fluoro-4-nitro-phenyl)phenyl]-4-keto-butyric acid Formula: C16H12FNO5 MolecularWeight: 317.268583

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12FNO5/c17-14-9-10(18(22)23)5-6-12(14)11-3-1-2-4-13(11)15(19)7-8-16(20)21/h1-6,9H,7-8H2,(H,20,21)