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Details

Stereochemistry ABSOLUTE
Molecular Formula C19H15Cl3N2O4
Molecular Weight 441.692
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-((2,4,5-TRICHLOROPHENOXY)ACETYL)-L-TRYPTOPHAN

SMILES

OC(=O)[C@H](CC1=CNC2=C1C=CC=C2)NC(=O)COC3=C(Cl)C=C(Cl)C(Cl)=C3

InChI

InChIKey=AFQHMLMYZPOSFP-INIZCTEOSA-N
InChI=1S/C19H15Cl3N2O4/c20-12-6-14(22)17(7-13(12)21)28-9-18(25)24-16(19(26)27)5-10-8-23-15-4-2-1-3-11(10)15/h1-4,6-8,16,23H,5,9H2,(H,24,25)(H,26,27)/t16-/m0/s1

HIDE SMILES / InChI

Molecular Formula C19H15Cl3N2O4
Molecular Weight 441.692
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:02:08 GMT 2023
Edited
by admin
on Sat Dec 16 08:02:08 GMT 2023
Record UNII
B901354401
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-((2,4,5-TRICHLOROPHENOXY)ACETYL)-L-TRYPTOPHAN
Systematic Name English
L-TRYPTOPHAN, N-((2,4,5-TRICHLOROPHENOXY)ACETYL)-
Systematic Name English
Code System Code Type Description
FDA UNII
B901354401
Created by admin on Sat Dec 16 08:02:08 GMT 2023 , Edited by admin on Sat Dec 16 08:02:08 GMT 2023
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PUBCHEM
149865
Created by admin on Sat Dec 16 08:02:09 GMT 2023 , Edited by admin on Sat Dec 16 08:02:09 GMT 2023
PRIMARY
CAS
66789-82-0
Created by admin on Sat Dec 16 08:02:08 GMT 2023 , Edited by admin on Sat Dec 16 08:02:08 GMT 2023
PRIMARY
EPA CompTox
DTXSID50985353
Created by admin on Sat Dec 16 08:02:08 GMT 2023 , Edited by admin on Sat Dec 16 08:02:08 GMT 2023
PRIMARY