3-Amino-5-[[(2,3-dihydroxypropyl)amino]carbonyl]-2,4,6-triiodobenzoic acid

CAS Registry Number®

111453-32-8

CAS Name

3-Amino-5-[[(2,3-dihydroxypropyl)amino]carbonyl]-2,4,6-triiodobenzoic acid

Molecular Formula

C11H11I3N2O5

Molecular Mass

631.93

Cite this Page

3-Amino-5-[[(2,3-dihydroxypropyl)amino]carbonyl]-2,4,6-triiodobenzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=111453-32-8 (retrieved 2024-11-21) (CAS RN: 111453-32-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C11H11I3N2O5/c12-6-4(10(19)16-1-3(18)2-17)7(13)9(15)8(14)5(6)11(20)21/h3,17-18H,1-2,15H2,(H,16,19)(H,20,21)

InChIKey

InChIKey=URFBLIYCWAORDM-UHFFFAOYSA-N

SMILES

C(NCC(CO)O)(=O)C1=C(I)C(C(O)=O)=C(I)C(N)=C1I

Canonical SMILES

O=C(O)C1=C(I)C(N)=C(I)C(C(=O)NCC(O)CO)=C1I

Other Names for this Substance

  • Benzoic acid, 3-amino-5-[[(2,3-dihydroxypropyl)amino]carbonyl]-2,4,6-triiodo-
  • 3-Amino-5-[[(2,3-dihydroxypropyl)amino]carbonyl]-2,4,6-triiodobenzoic acid
  • 5-Amino-N-(2,3-dihydroxypropyl)-2,4,6-triiodoisophthalamide acid
  • 3-Amino-5-((2,3-dihydroxypropyl)carbamoyl)-2,4,6-triiodobenzoic acid

CAS INSIGHTSTM
Targeted protein degrader structure, illustration