3-(((2,3-BIS(ACETYLOXY)PROPYL)AMINO)CARBONYL)-5-(DIACETYLAMINO)-2,4,6-TRIIODOBENZOIC ACID

Details

Stereochemistry	RACEMIC
Molecular Formula	C19H19I3N2O9
Molecular Weight	800.0756
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3-(((2,3-BIS(ACETYLOXY)PROPYL)AMINO)CARBONYL)-5-(DIACETYLAMINO)-2,4,6-TRIIODOBENZOIC ACID

Structure Search

SMILES

CC(=O)OCC(CNC(=O)C1=C(I)C(N(C(C)=O)C(C)=O)=C(I)C(C(O)=O)=C1I)OC(C)=O

InChI

InChIKey=ZZBQOACFJTXVER-UHFFFAOYSA-N

InChI=1S/C19H19I3N2O9/c1-7(25)24(8(2)26)17-15(21)12(14(20)13(16(17)22)19(30)31)18(29)23-5-11(33-10(4)28)6-32-9(3)27/h11H,5-6H2,1-4H3,(H,23,29)(H,30,31)

HIDE SMILES / InChI

Molecular Formula	C19H19I3N2O9
Molecular Weight	800.0756
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 22:10:39 GMT 2025` Edited by `admin` on `Tue Apr 01 22:10:39 GMT 2025`
Record UNII	MRB5SKE2ZK
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3-(((2,3-BIS(ACETYLOXY)PROPYL)AMINO)CARBONYL)-5-(DIACETYLAMINO)-2,4,6-TRIIODOBENZOIC ACID

Systematic Name

English

3-(ACETYLAMINO)-5-(DIACETYLAMINO)-2,4,6-TRIIODOBENZOIC ACID

Preferred Name

English

BENZOIC ACID, 3-(((2,3-BIS(ACETYLOXY)PROPYL)AMINO)CARBONYL)-5-(DIACETYLAMINO)-2,4,6-TRIIODO-

Systematic Name

English

Code System Code Type Description

PUBCHEM

21466685

Created by admin on Tue Apr 01 22:10:39 GMT 2025 , Edited by admin on Tue Apr 01 22:10:39 GMT 2025

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CAS

134768-66-4

Created by admin on Tue Apr 01 22:10:39 GMT 2025 , Edited by admin on Tue Apr 01 22:10:39 GMT 2025

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FDA UNII

MRB5SKE2ZK

Created by admin on Tue Apr 01 22:10:39 GMT 2025 , Edited by admin on Tue Apr 01 22:10:39 GMT 2025

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DIATRIZOIC ACID

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