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Details

Stereochemistry ABSOLUTE
Molecular Formula C17H22ClI2N3O8
Molecular Weight 685.634
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-CHLORO-N1,N3-BIS(1,3-DIHYDROXYPROPAN-2-YL)-5-(S)-LACTAMIDO-2,6-DIIODOISOPHTHALAMIDE

SMILES

C[C@H](O)C(=O)NC1=C(I)C(C(=O)NC(CO)CO)=C(I)C(C(=O)NC(CO)CO)=C1Cl

InChI

InChIKey=KAAZHOLBYCSXBH-LURJTMIESA-N
InChI=1S/C17H22ClI2N3O8/c1-6(28)15(29)23-14-11(18)9(16(30)21-7(2-24)3-25)12(19)10(13(14)20)17(31)22-8(4-26)5-27/h6-8,24-28H,2-5H2,1H3,(H,21,30)(H,22,31)(H,23,29)/t6-/m0/s1

HIDE SMILES / InChI

Molecular Formula C17H22ClI2N3O8
Molecular Weight 685.634
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 11:19:38 GMT 2023
Edited
by admin
on Sat Dec 16 11:19:38 GMT 2023
Record UNII
Z97BN2VV38
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-CHLORO-N1,N3-BIS(1,3-DIHYDROXYPROPAN-2-YL)-5-(S)-LACTAMIDO-2,6-DIIODOISOPHTHALAMIDE
Systematic Name English
IOPAMIDOL RELATED COMPOUND C [USP-RS]
Common Name English
IOPAMIDOL RELATED COMPOUND C [USP IMPURITY]
Common Name English
Code System Code Type Description
PUBCHEM
125333440
Created by admin on Sat Dec 16 11:19:39 GMT 2023 , Edited by admin on Sat Dec 16 11:19:39 GMT 2023
PRIMARY
FDA UNII
Z97BN2VV38
Created by admin on Sat Dec 16 11:19:39 GMT 2023 , Edited by admin on Sat Dec 16 11:19:39 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY