U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C13H13I3N2O4
Molecular Weight 641.9667
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DIATRIZOATE ETHYL

SMILES

CCOC(=O)C1=C(I)C(NC(C)=O)=C(I)C(NC(C)=O)=C1I

InChI

InChIKey=OBISGMNJKBVZBT-UHFFFAOYSA-N
InChI=1S/C13H13I3N2O4/c1-4-22-13(21)7-8(14)11(17-5(2)19)10(16)12(9(7)15)18-6(3)20/h4H2,1-3H3,(H,17,19)(H,18,20)

HIDE SMILES / InChI

Approval Year

Name Type Language
DIATRIZOATE ETHYL
Common Name English
ETHYL DIATRIZOATE
Common Name English
ETHYL 3,5-BIS(ACETYLAMINO)-2,4,6-TRIIODOBENZOATE
Systematic Name English
WIN-8883
Code English
DIATRIZOIC ACID, ETHYL ESTER
Common Name English
3,5-DIACETAMIDO-2,4,6-TRIIODO-BENZOIC ACID ETHYL ESTER
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID70176069
Created by admin on Fri Dec 15 15:34:45 UTC 2023 , Edited by admin on Fri Dec 15 15:34:45 UTC 2023
PRIMARY
PUBCHEM
16567
Created by admin on Fri Dec 15 15:34:45 UTC 2023 , Edited by admin on Fri Dec 15 15:34:45 UTC 2023
PRIMARY
CAS
2168-75-4
Created by admin on Fri Dec 15 15:34:45 UTC 2023 , Edited by admin on Fri Dec 15 15:34:45 UTC 2023
PRIMARY
FDA UNII
85KD8I5N2U
Created by admin on Fri Dec 15 15:34:45 UTC 2023 , Edited by admin on Fri Dec 15 15:34:45 UTC 2023
PRIMARY