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Details

Stereochemistry ACHIRAL
Molecular Formula C20H36N4O8
Molecular Weight 460.5218
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-tert-butyl 1,4,7,10-Tetraazacyclododecane-1,4,7,10-tetraacetate

SMILES

CC(C)(C)OC(=O)CN1CCN(CC(O)=O)CCN(CC(O)=O)CCN(CC(O)=O)CC1

InChI

InChIKey=UTRYHKPHZFLLBR-UHFFFAOYSA-N
InChI=1S/C20H36N4O8/c1-20(2,3)32-19(31)15-24-10-8-22(13-17(27)28)6-4-21(12-16(25)26)5-7-23(9-11-24)14-18(29)30/h4-15H2,1-3H3,(H,25,26)(H,27,28)(H,29,30)

HIDE SMILES / InChI

Molecular Formula C20H36N4O8
Molecular Weight 460.5218
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 19:17:54 GMT 2023
Edited
by admin
on Sat Dec 16 19:17:54 GMT 2023
Record UNII
3EUA87732C
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-tert-butyl 1,4,7,10-Tetraazacyclododecane-1,4,7,10-tetraacetate
Systematic Name English
1-(1,1-Dimethylethyl) 1,4,7,10-tetraazacyclododecane-1,4,7,10-tetraacetate
Systematic Name English
1,4,7,10-Tetraazacyclododecane-1,4,7,10-tetraacetic acid, 1-(1,1-dimethylethyl) ester
Systematic Name English
Code System Code Type Description
PUBCHEM
118103271
Created by admin on Sat Dec 16 19:17:54 GMT 2023 , Edited by admin on Sat Dec 16 19:17:54 GMT 2023
PRIMARY
CAS
1516879-90-5
Created by admin on Sat Dec 16 19:17:54 GMT 2023 , Edited by admin on Sat Dec 16 19:17:54 GMT 2023
PRIMARY
FDA UNII
3EUA87732C
Created by admin on Sat Dec 16 19:17:54 GMT 2023 , Edited by admin on Sat Dec 16 19:17:54 GMT 2023
PRIMARY