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(2-methoxy-2-oxidanylidene-ethyl) 4-methylsulfanyl-3-nitro-benzoate

(2-methoxy-2-oxidanylidene-ethyl) 4-methylsulfanyl-3-nitro-benzoate

Systemtic Name:(2-methoxy-2-oxidanylidene-ethyl) 4-methylsulfanyl-3-nitro-benzoate
Openeye Name:(2-methoxy-2-oxo-ethyl) 4-methylsulfanyl-3-nitro-benzoate
CAS Name:4-(methylthio)-3-nitrobenzoic acid (2-methoxy-2-oxoethyl) ester
IUPAC Name:(2-methoxy-2-oxoethyl) 4-methylsulfanyl-3-nitrobenzoate
Traditional Name:4-(methylthio)-3-nitro-benzoic acid (2-keto-2-methoxy-ethyl) ester
Formula: C11H11NO6S
MolecularWeight: 285.27314
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C11H11NO6S/c1-17-10(13)6-18-11(14)7-3-4-9(19-2)8(5-7)12(15)16/h3-5H,6H2,1-2H3


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