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4-(diethoxyphosphorylmethylsulfanyl)benzoic acid

4-(diethoxyphosphorylmethylsulfanyl)benzoic acid

Systemtic Name:4-(diethoxyphosphorylmethylsulfanyl)benzoic acid
Openeye Name:4-(diethoxyphosphorylmethylsulfanyl)benzoic acid
CAS Name:4-(diethoxyphosphorylmethylthio)benzoic acid
IUPAC Name:4-(diethoxyphosphorylmethylsulfanyl)benzoic acid
Traditional Name:4-(diethoxyphosphorylmethylthio)benzoic acid
Formula: C12H17O5PS
MolecularWeight: 304.299141
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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(CSC1=CC=C(C=C1)C(=O)O)OCC


Isomeric SMILES

CCOP(=O)(CSC1=CC=C(C=C1)C(=O)O)OCC


InChI

InChI=1S/C12H17O5PS/c1-3-16-18(15,17-4-2)9-19-11-7-5-10(6-8-11)12(13)14/h5-8H,3-4,9H2,1-2H3,(H,13,14)


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