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Details

Stereochemistry ABSOLUTE
Molecular Formula C16H20I3N3O7
Molecular Weight 747.0593
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N1-(1,3-DIHYDROXYPROPAN-2-YL)-N3-(2-HYDROXYETHYL)-5-(2-HYDROXYPROPANAMIDE)-2,4,6-TRIIODISOPHTHALAMIDE, (S)-

SMILES

C[C@H](O)C(=O)NC1=C(I)C(C(=O)NCCO)=C(I)C(C(=O)NC(CO)CO)=C1I

InChI

InChIKey=JFGLLCPCXNIKNW-LURJTMIESA-N
InChI=1S/C16H20I3N3O7/c1-6(26)14(27)22-13-11(18)8(15(28)20-2-3-23)10(17)9(12(13)19)16(29)21-7(4-24)5-25/h6-7,23-26H,2-5H2,1H3,(H,20,28)(H,21,29)(H,22,27)/t6-/m0/s1

HIDE SMILES / InChI

Molecular Formula C16H20I3N3O7
Molecular Weight 747.0593
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 10:37:44 UTC 2023
Edited
by admin
on Sat Dec 16 10:37:44 UTC 2023
Record UNII
4S833F9URJ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N1-(1,3-DIHYDROXYPROPAN-2-YL)-N3-(2-HYDROXYETHYL)-5-(2-HYDROXYPROPANAMIDE)-2,4,6-TRIIODISOPHTHALAMIDE, (S)-
Systematic Name English
1,3-BENZENEDICARBOXAMIDE, N-(2-HYDROXYETHYL)-N'-(2-HYDROXY-1-(HYDROXYMETHYL)ETHYL)-5-((2-HYDROXY-1-OXOPROPYL)AMINO)-2,4,6-TRIIODO-, (S)-
Systematic Name English
(S)-N1-(1,3-DIHYDROXYPROPAN-2-YL)-N3-(2-HYDROXYETHYL)-5-(2-HYDROXYPROPANAMIDE)-2,4,6-TRIIODISOPHTHALAMIDE
Systematic Name English
IOPAMIDOL IMPURITY J
Common Name English
Code System Code Type Description
FDA UNII
4S833F9URJ
Created by admin on Sat Dec 16 10:37:45 UTC 2023 , Edited by admin on Sat Dec 16 10:37:45 UTC 2023
PRIMARY
PUBCHEM
156613769
Created by admin on Sat Dec 16 10:37:45 UTC 2023 , Edited by admin on Sat Dec 16 10:37:45 UTC 2023
PRIMARY
CAS
77868-44-1
Created by admin on Sat Dec 16 10:37:45 UTC 2023 , Edited by admin on Sat Dec 16 10:37:45 UTC 2023
PRIMARY
Related Record Type Details
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