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

Details

Stereochemistry ACHIRAL
Molecular Formula C20H40N4O4
Molecular Weight 400.556
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,4,7,10-Tetraazacyclododecane-1,4-diacetic acid, bis(1,1-dimethylethyl) ester

SMILES

CC(C)(C)OC(=O)CN1CCNCCNCCN(CC(=O)OC(C)(C)C)CC1

InChI

InChIKey=LYKZIJFLYFMEBC-UHFFFAOYSA-N
InChI=1S/C20H40N4O4/c1-19(2,3)27-17(25)15-23-11-9-21-7-8-22-10-12-24(14-13-23)16-18(26)28-20(4,5)6/h21-22H,7-16H2,1-6H3

HIDE SMILES / InChI

Approval Year

Name Type Language
1,4,7,10-Tetraazacyclododecane-1,4-diacetic acid, bis(1,1-dimethylethyl) ester
Systematic Name English
1,4-Bis(1,1-dimethylethyl) 1,4,7,10-tetraazacyclododecane-1,4-diacetate
Systematic Name English
1,4,7,10-Tetraazacyclododecane-1,4-diacetic acid, 1,4-bis(1,1-dimethylethyl) ester
Systematic Name English
di-tert-Butyl 2,2'-(1,4,7,10-tetraazacyclododecane-1,4-diyl)diacetate
Systematic Name English
Code System Code Type Description
PUBCHEM
11338559
Created by admin on Sat Dec 16 19:22:46 GMT 2023 , Edited by admin on Sat Dec 16 19:22:46 GMT 2023
PRIMARY
CAS
507475-91-4
Created by admin on Sat Dec 16 19:22:46 GMT 2023 , Edited by admin on Sat Dec 16 19:22:46 GMT 2023
PRIMARY
FDA UNII
2RCG2W2DMK
Created by admin on Sat Dec 16 19:22:46 GMT 2023 , Edited by admin on Sat Dec 16 19:22:46 GMT 2023
PRIMARY