N-[2-(2,4,5-trichlorophenoxy)propanoyl]methionine (Q82013735)

chemical compound

N-[1-Hydroxy-2-(2,4,5-trichlorophenoxy)propylidene]methionine

Language	Label	Description	Also known as
English	N-[2-(2,4,5-trichlorophenoxy)propanoyl]methionine	chemical compound	N-[1-Hydroxy-2-(2,4,5-trichlorophenoxy)propylidene]methionine

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instance of

type of chemical entity

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subclass of

chemical compound

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mass

398.98656203199994 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₁₄H₁₆Cl₃NO₄S

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based on heuristic

inferred from SMILES

canonical SMILES

CSCCC(NC(=O)C(C)Oc1cc(Cl)c(Cl)cc1Cl)C(=O)O

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based on heuristic

inferred from InChI

Identifiers

InChI

InChI=1S/C14H16Cl3NO4S/c1-7(13(19)18-11(14(20)21)3-4-23-2)22-12-6-9(16)8(15)5-10(12)17/h5-7,11H,3-4H2,1-2H3,(H,18,19)(H,20,21)

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InChIKey

NRUSDLROOFCNFQ-UHFFFAOYSA-N

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1 reference

26 December 2021

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DSSTOX compound identifier

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N-[2-(2,4,5-trichlorophenoxy)propanoyl]methionine (Q82013735)

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N-[2-(2,4,5-trichlorophenoxy)propanoyl]methionine (Q82013735)

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