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(Q82828073)
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English
(R)-Cyano(naphthalen-2-yl)methyl diethyl phosphate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
319.097344686
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₆H₁₈NO₄P
0 references
canonical SMILES
CCOP(=O)(OCC)OC(C#N)c1ccc2ccccc2c1
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CCOP(=O)(OCC)O[C@@H](C#N)C1=CC2=CC=CC=C2C=C1
0 references
Identifiers
InChI
InChI=1S/C16H18NO4P/c1-3-19-22(18,20-4-2)21-16(12-17)15-10-9-13-7-5-6-8-14(13)11-15/h5-11,16H,3-4H2,1-2H3/t16-/m0/s1
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InChIKey
OYLWRGIGSIHXMY-INIZCTEOSA-N
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CAS Registry Number
820969-50-4
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PubChem CID
71420194
1 reference
matched by identifier from
InChIKey
InChIKey
OYLWRGIGSIHXMY-INIZCTEOSA-N
UniChem compound ID
51010303
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID30839401
1 reference
matched by identifier from
InChIKey
InChIKey
OYLWRGIGSIHXMY-INIZCTEOSA-N
DSSTOX compound identifier
DTXCID70790143
0 references
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