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ethyl 2-phenylsulfanylcarbonylbutanoate

ethyl 2-phenylsulfanylcarbonylbutanoate

Systemtic Name:ethyl 2-phenylsulfanylcarbonylbutanoate
Openeye Name:ethyl 2-phenylsulfanylcarbonylbutanoate
CAS Name:2-[oxo-(phenylthio)methyl]butanoic acid ethyl ester
IUPAC Name:ethyl 2-phenylsulfanylcarbonylbutanoate
Traditional Name:2-(phenylthio)carbonylbutyric acid ethyl ester
Formula: C13H16O3S
MolecularWeight: 252.32934
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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OCC)C(=O)SC1=CC=CC=C1


Isomeric SMILES

CCC(C(=O)OCC)C(=O)SC1=CC=CC=C1


InChI

InChI=1S/C13H16O3S/c1-3-11(12(14)16-4-2)13(15)17-10-8-6-5-7-9-10/h5-9,11H,3-4H2,1-2H3


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