o-Cresolphthalein complexone

CAS Registry Number®

2411-89-4

CAS Name

o-Cresolphthalein complexone

Molecular Formula

C32H32N2O12

Molecular Mass

636.60

Cite this Page

o-Cresolphthalein complexone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=2411-89-4 (retrieved 2024-11-21) (CAS RN: 2411-89-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C32H32N2O12/c1-17-7-21(9-19(29(17)43)11-33(13-25(35)36)14-26(37)38)32(24-6-4-3-5-23(24)31(45)46-32)22-8-18(2)30(44)20(10-22)12-34(15-27(39)40)16-28(41)42/h3-10,43-44H,11-16H2,1-2H3,(H,35,36)(H,37,38)(H,39,40)(H,41,42)

InChIKey

InChIKey=IYZPEGVSBUNMBE-UHFFFAOYSA-N

SMILES

O=C1OC(C=2C1=CC=CC2)(C3=CC(CN(CC(O)=O)CC(O)=O)=C(O)C(C)=C3)C4=CC(CN(CC(O)=O)CC(O)=O)=C(O)C(C)=C4

Canonical SMILES

O=C(O)CN(CC(=O)O)CC=1C=C(C=C(C1O)C)C2(OC(=O)C=3C=CC=CC32)C=4C=C(C(O)=C(C4)CN(CC(=O)O)CC(=O)O)C

Other Names for this Substance

  • Glycine, N,N′-[(3-oxo-1(3H)-isobenzofuranylidene)bis[(6-hydroxy-5-methyl-3,1-phenylene)methylene]]bis[N-(carboxymethyl)-
  • Phenolphthalein, 3′,3′′-bis[[bis(carboxymethyl)amino]methyl]-5′,5′′-dimethyl-
  • N,N′-[(3-Oxo-1(3H)-isobenzofuranylidene)bis[(6-hydroxy-5-methyl-3,1-phenylene)methylene]]bis[N-(carboxymethyl)glycine]
  • Cresolphthalein complexon
  • o-Cresolphthalein complexon

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration