2-[4-[bis(fluoranyl)methoxy]-3-nitro-phenyl]-3-methyl-butanoic acid

Systemtic Name: 2-[4-[bis(fluoranyl)methoxy]-3-nitro-phenyl]-3-methyl-butanoic acid Openeye Name: 2-[4-(difluoromethoxy)-3-nitro-phenyl]-3-methyl-butanoic acid CAS Name: 2-[4-(difluoromethoxy)-3-nitrophenyl]-3-methylbutanoic acid IUPAC Name: 2-[4-(difluoromethoxy)-3-nitrophenyl]-3-methylbutanoic acid Traditional Name: 2-[4-(difluoromethoxy)-3-nitro-phenyl]-3-methyl-butyric acid Formula: C12H13F2NO5 MolecularWeight: 289.232126

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13F2NO5/c1-6(2)10(11(16)17)7-3-4-9(20-12(13)14)8(5-7)15(18)19/h3-6,10,12H,1-2H3,(H,16,17)