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(4-nitrophenyl)methyl 4-methylsulfanyl-3-oxidanylidene-butanoate

(4-nitrophenyl)methyl 4-methylsulfanyl-3-oxidanylidene-butanoate

Systemtic Name:(4-nitrophenyl)methyl 4-methylsulfanyl-3-oxidanylidene-butanoate
Openeye Name:(4-nitrophenyl)methyl 4-methylsulfanyl-3-oxo-butanoate
CAS Name:4-(methylthio)-3-oxobutanoic acid (4-nitrophenyl)methyl ester
IUPAC Name:(4-nitrophenyl)methyl 4-methylsulfanyl-3-oxobutanoate
Traditional Name:3-keto-4-(methylthio)butyric acid (4-nitrobenzyl) ester
Formula: C12H13NO5S
MolecularWeight: 283.30032
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Descriptors Computed from Structure

Canonical SMILES:

CSCC(=O)CC(=O)OCC1=CC=C(C=C1)[N+](=O)[O-]


Isomeric SMILES

CSCC(=O)CC(=O)OCC1=CC=C(C=C1)[N+](=O)[O-]


InChI

InChI=1S/C12H13NO5S/c1-19-8-11(14)6-12(15)18-7-9-2-4-10(5-3-9)13(16)17/h2-5H,6-8H2,1H3


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