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Details

Stereochemistry RACEMIC
Molecular Formula C18H24I3N3O9
Molecular Weight 807.1113
Optical Activity ( + / - )
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N,N'-Bis(2,3-dihydroxypropyl)-5-{[N-(2-hydroxyethyl)amino]-2-oxoethoxy}-2,4,6-triiodoisophthalamide

SMILES

OCCNC(=O)COC1=C(I)C(C(=O)NCC(O)CO)=C(I)C(C(=O)NCC(O)CO)=C1I

InChI

InChIKey=QDBZQPODJFKLML-UHFFFAOYSA-N
InChI=1S/C18H24I3N3O9/c19-13-11(17(31)23-3-8(28)5-26)14(20)16(33-7-10(30)22-1-2-25)15(21)12(13)18(32)24-4-9(29)6-27/h8-9,25-29H,1-7H2,(H,22,30)(H,23,31)(H,24,32)

HIDE SMILES / InChI

Molecular Formula C18H24I3N3O9
Molecular Weight 807.1113
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:43:43 UTC 2023
Edited
by admin
on Sat Dec 16 18:43:43 UTC 2023
Record UNII
K8RN54FJV8
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N,N'-Bis(2,3-dihydroxypropyl)-5-{[N-(2-hydroxyethyl)amino]-2-oxoethoxy}-2,4,6-triiodoisophthalamide
Systematic Name English
N,N'-BIS(2,3-DIHYDROXYPROPYL)-5-((N-(2-HYDROXYETHYL)-CARBAMOYL)METHOXY)-2,4,6-TRIIODOISOPHTHALAMIDE
Systematic Name English
1,3-Benzenedicarboxamide, N,N′-bis(2,3-dihydroxypropyl)-5-[2-[(2-hydroxyethyl)amino]-2-oxoethoxy]-2,4,6-triiodo-
Systematic Name English
Ioversol Related Compound B
Common Name English
IOVERSOL RELATED COMPOUND B [USP IMPURITY]
Common Name English
Code System Code Type Description
CAS
104517-96-6
Created by admin on Sat Dec 16 18:43:43 UTC 2023 , Edited by admin on Sat Dec 16 18:43:43 UTC 2023
PRIMARY
PUBCHEM
19019673
Created by admin on Sat Dec 16 18:43:43 UTC 2023 , Edited by admin on Sat Dec 16 18:43:43 UTC 2023
PRIMARY
FDA UNII
K8RN54FJV8
Created by admin on Sat Dec 16 18:43:43 UTC 2023 , Edited by admin on Sat Dec 16 18:43:43 UTC 2023
PRIMARY
RS_ITEM_NUM
1345126
Created by admin on Sat Dec 16 18:43:43 UTC 2023 , Edited by admin on Sat Dec 16 18:43:43 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP