5-[[(1-Hydroxy-2-naphthalenyl)carbonyl]octadecylamino]-1,3-benzenedicarboxylic acid

CAS Registry Number®

26639-29-2

CAS Name

5-[[(1-Hydroxy-2-naphthalenyl)carbonyl]octadecylamino]-1,3-benzenedicarboxylic acid

Molecular Formula

C37H49NO6

Molecular Mass

603.79

Cite this Page

5-[[(1-Hydroxy-2-naphthalenyl)carbonyl]octadecylamino]-1,3-benzenedicarboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=26639-29-2 (retrieved 2024-11-21) (CAS RN: 26639-29-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C37H49NO6/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-24-38(31-26-29(36(41)42)25-30(27-31)37(43)44)35(40)33-23-22-28-20-17-18-21-32(28)34(33)39/h17-18,20-23,25-27,39H,2-16,19,24H2,1H3,(H,41,42)(H,43,44)

InChIKey

InChIKey=OBCOPYLXZAHBGX-UHFFFAOYSA-N

SMILES

N(C(=O)C1=C(O)C2=C(C=C1)C=CC=C2)(CCCCCCCCCCCCCCCCCC)C3=CC(C(O)=O)=CC(C(O)=O)=C3

Canonical SMILES

O=C(O)C=1C=C(C=C(C1)N(C(=O)C=2C=CC=3C=CC=CC3C2O)CCCCCCCCCCCCCCCCCC)C(=O)O

Other Names for this Substance

  • 1,3-Benzenedicarboxylic acid, 5-[[(1-hydroxy-2-naphthalenyl)carbonyl]octadecylamino]-
  • Isophthalic acid, 5-(1-hydroxy-N-octadecyl-2-naphthamido)-
  • 5-[[(1-Hydroxy-2-naphthalenyl)carbonyl]octadecylamino]-1,3-benzenedicarboxylic acid
  • 1-Hydroxy-n-octadecyl-n-(3,5-dicarboxy-phenyl)-2-naphthamide

CAS INSIGHTSTM
Targeted protein degrader structure, illustration