5-((2-HYDROXYACETYL)AMINO)-N1,N3-BIS(2-HYDROXY-1-(HYDROXYMETHYL)ETHYL)-2,4,6-TRIIODO-1,3-BENZENEDICARBOXAMIDE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C16H20I3N3O8
Molecular Weight	763.0587
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 5-((2-HYDROXYACETYL)AMINO)-N1,N3-BIS(2-HYDROXY-1-(HYDROXYMETHYL)ETHYL)-2,4,6-TRIIODO-1,3-BENZENEDICARBOXAMIDE

Structure Search

SMILES

OCC(CO)NC(=O)C1=C(I)C(C(=O)NC(CO)CO)=C(I)C(NC(=O)CO)=C1I

InChI

InChIKey=BPSXCZTZZDIVJV-UHFFFAOYSA-N

InChI=1S/C16H20I3N3O8/c17-11-9(15(29)20-6(1-23)2-24)12(18)14(22-8(28)5-27)13(19)10(11)16(30)21-7(3-25)4-26/h6-7,23-27H,1-5H2,(H,20,29)(H,21,30)(H,22,28)

HIDE SMILES / InChI

Molecular Formula	C16H20I3N3O8
Molecular Weight	763.0587
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 `Mon Mar 31 23:22:01 GMT 2025` Edited by `admin` on `Mon Mar 31 23:22:01 GMT 2025`
Record UNII	54K5BMM8OD
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

IOPAMIDOL RELATED COMPOUND B [USP IMPURITY]

Preferred Name

English

5-((2-HYDROXYACETYL)AMINO)-N1,N3-BIS(2-HYDROXY-1-(HYDROXYMETHYL)ETHYL)-2,4,6-TRIIODO-1,3-BENZENEDICARBOXAMIDE

Common Name

English

IOPAMIDOL RELATED COMPOUND B [USP-RS]

Common Name

English

5-GLYCOLAMIDO-N,N'-BIS(2-HYDROXY-1-(HYDROXYMETHYL)ETHYL)-2,4,6-TRIIODOISOPHTHALAMIDE)

Systematic Name

English

1,3-BENZENEDICARBOXAMIDE, 5-((2-HYDROXYACETYL)AMINO)-N1,N3-BIS(2-HYDROXY-1-(HYDROXYMETHYL)ETHYL)-2,4,6-TRIIODO-

Systematic Name

English

Code System Code Type Description

CAS

77868-41-8

Created by admin on Mon Mar 31 23:22:01 GMT 2025 , Edited by admin on Mon Mar 31 23:22:01 GMT 2025

PRIMARY

RS_ITEM_NUM

1344735

Created by admin on Mon Mar 31 23:22:01 GMT 2025 , Edited by admin on Mon Mar 31 23:22:01 GMT 2025

PRIMARY

FDA UNII

54K5BMM8OD

Created by admin on Mon Mar 31 23:22:01 GMT 2025 , Edited by admin on Mon Mar 31 23:22:01 GMT 2025

PRIMARY

PUBCHEM

13589964

Created by admin on Mon Mar 31 23:22:01 GMT 2025 , Edited by admin on Mon Mar 31 23:22:01 GMT 2025

PRIMARY

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Iopamidol

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Qualification:

USP

Amount: