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Details

Stereochemistry ACHIRAL
Molecular Formula C25H28INO5
Molecular Weight 549.398
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-BENZOFURANBUTANOIC ACID, 3-(4-(2-(DIETHYLAMINO)ETHOXY)-3-IODOBENZOYL)-

SMILES

CCN(CC)CCOC1=C(I)C=C(C=C1)C(=O)C2=C(CCCC(O)=O)OC3=C2C=CC=C3

InChI

InChIKey=QLXMMDUCEAYUQO-UHFFFAOYSA-N
InChI=1S/C25H28INO5/c1-3-27(4-2)14-15-31-21-13-12-17(16-19(21)26)25(30)24-18-8-5-6-9-20(18)32-22(24)10-7-11-23(28)29/h5-6,8-9,12-13,16H,3-4,7,10-11,14-15H2,1-2H3,(H,28,29)

HIDE SMILES / InChI

Molecular Formula C25H28INO5
Molecular Weight 549.398
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 Thu Jul 06 20:44:43 UTC 2023
Edited
by admin
on Thu Jul 06 20:44:43 UTC 2023
Record UNII
5LHV8RAE8X
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-BENZOFURANBUTANOIC ACID, 3-(4-(2-(DIETHYLAMINO)ETHOXY)-3-IODOBENZOYL)-
Systematic Name English
AMIODARONE METABOLITE M4
Common Name English
Code System Code Type Description
FDA UNII
5LHV8RAE8X
Created by admin on Thu Jul 06 20:44:43 UTC 2023 , Edited by admin on Thu Jul 06 20:44:43 UTC 2023
PRIMARY
PUBCHEM
118753324
Created by admin on Thu Jul 06 20:44:43 UTC 2023 , Edited by admin on Thu Jul 06 20:44:43 UTC 2023
PRIMARY
CAS
1355969-13-9
Created by admin on Thu Jul 06 20:44:43 UTC 2023 , Edited by admin on Thu Jul 06 20:44:43 UTC 2023
PRIMARY
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