5-[[(2S)-2-(Acetyloxy)-1-oxopropyl]amino]-N1-(2,3-dihydroxypropyl)-N3-[2-hydroxy-1-(hydroxymethyl)ethyl]-2,4,6-triiodo-1,3-benzenedicarboxamide

Details

Stereochemistry	EPIMERIC
Molecular Formula	C19H24I3N3O9
Molecular Weight	819.122
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 5-[[(2S)-2-(Acetyloxy)-1-oxopropyl]amino]-N1-(2,3-dihydroxypropyl)-N3-[2-hydroxy-1-(hydroxymethyl)ethyl]-2,4,6-triiodo-1,3-benzenedicarboxamide

Structure Search

SMILES

C[C@H](OC(C)=O)C(=O)NC1=C(I)C(C(=O)NCC(O)CO)=C(I)C(C(=O)NC(CO)CO)=C1I

InChI

InChIKey=VJVUQTASVPUOBV-BYDSUWOYSA-N

InChI=1S/C19H24I3N3O9/c1-7(34-8(2)29)17(31)25-16-14(21)11(18(32)23-3-10(30)6-28)13(20)12(15(16)22)19(33)24-9(4-26)5-27/h7,9-10,26-28,30H,3-6H2,1-2H3,(H,23,32)(H,24,33)(H,25,31)/t7-,10?/m0/s1

HIDE SMILES / InChI

Molecular Formula	C19H24I3N3O9
Molecular Weight	819.122
Charge	0
Count

Stereochemistry	EPIMERIC
Additional Stereochemistry	No
Defined Stereocenters	1 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 20:56:22 GMT 2025` Edited by `admin` on `Wed Apr 02 20:56:22 GMT 2025`
Record UNII	UL2T8JZJ2L
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1,3-Benzenedicarboxamide, 5-[[(2S)-2-(acetyloxy)-1-oxopropyl]amino]-N1-(2,3-dihydroxypropyl)-N3-[2-hydroxy-1-(hydroxymethyl)ethyl]-2,4,6-triiodo-

Preferred Name

English

5-[[(2S)-2-(Acetyloxy)-1-oxopropyl]amino]-N1-(2,3-dihydroxypropyl)-N3-[2-hydroxy-1-(hydroxymethyl)ethyl]-2,4,6-triiodo-1,3-benzenedicarboxamide

Systematic Name

English

Code System Code Type Description

FDA UNII

UL2T8JZJ2L

Created by admin on Wed Apr 02 20:56:22 GMT 2025 , Edited by admin on Wed Apr 02 20:56:22 GMT 2025

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CAS

1869069-77-1

Created by admin on Wed Apr 02 20:56:22 GMT 2025 , Edited by admin on Wed Apr 02 20:56:22 GMT 2025

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