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Details

Stereochemistry MIXED
Molecular Formula C16H21I2N3O7
Molecular Weight 621.1628
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-ACETAMIDO-N1,N3-BIS(2,3-DIHYDROXYPROPYL)-2,4-DIIODOISOPHTHALAMIDE

SMILES

CC(=O)NC1=C(I)C(C(=O)NCC(O)CO)=C(I)C(=C1)C(=O)NCC(O)CO

InChI

InChIKey=XMFZSKWRHDLPFG-UHFFFAOYSA-N
InChI=1S/C16H21I2N3O7/c1-7(24)21-11-2-10(15(27)19-3-8(25)5-22)13(17)12(14(11)18)16(28)20-4-9(26)6-23/h2,8-9,22-23,25-26H,3-6H2,1H3,(H,19,27)(H,20,28)(H,21,24)

HIDE SMILES / InChI

Molecular Formula C16H21I2N3O7
Molecular Weight 621.1628
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 Wed Apr 02 09:47:23 GMT 2025
Edited
by admin
on Wed Apr 02 09:47:23 GMT 2025
Record UNII
S1OR7N7F3R
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5-ACETAMIDO-N1,N3-BIS(2,3-DIHYDROXYPROPYL)-2,4-DIIODOISOPHTHALAMIDE
Systematic Name English
(±)-5-ACETAMIDO-N1,N3-BIS(2,3-DIHYDROXYPROPYL)-2,4-DIIODOISOPHTHALAMIDE
Preferred Name English
5-(ACETYLAMINO)-N,N'-BIS(2,3-DIHYDROXYPROPYL)-2,4-DIIODOBENZENE-1,3-DICARBOXAMIDE
Systematic Name English
Code System Code Type Description
FDA UNII
S1OR7N7F3R
Created by admin on Wed Apr 02 09:47:23 GMT 2025 , Edited by admin on Wed Apr 02 09:47:23 GMT 2025
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PUBCHEM
139033183
Created by admin on Wed Apr 02 09:47:23 GMT 2025 , Edited by admin on Wed Apr 02 09:47:23 GMT 2025
PRIMARY