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5-nitro-2-(2-oxidanidyl-2-oxidanylidene-ethyl)sulfanyl-benzoate

5-nitro-2-(2-oxidanidyl-2-oxidanylidene-ethyl)sulfanyl-benzoate

Systemtic Name:5-nitro-2-(2-oxidanidyl-2-oxidanylidene-ethyl)sulfanyl-benzoate
Openeye Name:5-nitro-2-(2-oxido-2-oxo-ethyl)sulfanyl-benzoate
CAS Name:5-nitro-2-[(2-oxido-2-oxoethyl)thio]benzoate
IUPAC Name:5-nitro-2-(2-oxido-2-oxoethyl)sulfanylbenzoate
Traditional Name:2-[(2-keto-2-oxido-ethyl)thio]-5-nitro-benzoate
Formula: C9H5NO6S-2
MolecularWeight: 255.2041
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C9H7NO6S/c11-8(12)4-17-7-2-1-5(10(15)16)3-6(7)9(13)14/h1-3H,4H2,(H,11,12)(H,13,14)/p-2


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