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(2R)-2-(3,5-dinitrophenyl)sulfanylpropanoic acid

(2R)-2-(3,5-dinitrophenyl)sulfanylpropanoic acid

Systemtic Name:(2R)-2-(3,5-dinitrophenyl)sulfanylpropanoic acid
Openeye Name:(2R)-2-(3,5-dinitrophenyl)sulfanylpropanoic acid
CAS Name:(2R)-2-[(3,5-dinitrophenyl)thio]propanoic acid
IUPAC Name:(2R)-2-(3,5-dinitrophenyl)sulfanylpropanoic acid
Traditional Name:(2R)-2-[(3,5-dinitrophenyl)thio]propionic acid
Formula: C9H8N2O6S
MolecularWeight: 272.23462
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C9H8N2O6S/c1-5(9(12)13)18-8-3-6(10(14)15)2-7(4-8)11(16)17/h2-5H,1H3,(H,12,13)/t5-/m1/s1


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