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2-[2,4-dinitro-6-(trifluoromethyl)phenyl]propanedioic acid

2-[2,4-dinitro-6-(trifluoromethyl)phenyl]propanedioic acid

Systemtic Name:2-[2,4-dinitro-6-(trifluoromethyl)phenyl]propanedioic acid
Openeye Name:2-[2,4-dinitro-6-(trifluoromethyl)phenyl]propanedioic acid
CAS Name:2-[2,4-dinitro-6-(trifluoromethyl)phenyl]propanedioic acid
IUPAC Name:2-[2,4-dinitro-6-(trifluoromethyl)phenyl]propanedioic acid
Traditional Name:2-[2,4-dinitro-6-(trifluoromethyl)phenyl]malonic acid
Formula: C10H5F3N2O8
MolecularWeight: 338.15051
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C10H5F3N2O8/c11-10(12,13)4-1-3(14(20)21)2-5(15(22)23)6(4)7(8(16)17)9(18)19/h1-2,7H,(H,16,17)(H,18,19)


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