(2R)-2-[2,6-dinitro-4-(trifluoromethyl)phenyl]sulfanylpropanoate

Systemtic Name: (2R)-2-[2,6-dinitro-4-(trifluoromethyl)phenyl]sulfanylpropanoate Openeye Name: (2R)-2-[2,6-dinitro-4-(trifluoromethyl)phenyl]sulfanylpropanoate CAS Name: (2R)-2-[[2,6-dinitro-4-(trifluoromethyl)phenyl]thio]propanoate IUPAC Name: (2R)-2-[2,6-dinitro-4-(trifluoromethyl)phenyl]sulfanylpropanoate Traditional Name: (2R)-2-[[2,6-dinitro-4-(trifluoromethyl)phenyl]thio]propionate Formula: C10H6F3N2O6S- MolecularWeight: 339.22465

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])SC1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C(=O)[O-])SC1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C10H7F3N2O6S/c1-4(9(16)17)22-8-6(14(18)19)2-5(10(11,12)13)3-7(8)15(20)21/h2-4H,1H3,(H,16,17)/p-1/t4-/m1/s1