Benzeneacetic acid, 4-[bis(2-chloroethyl)amino]-, (1,2-diethyl-1,2-ethanediyl)di-4,1-phenylene ester

CAS Registry Number®

19659-38-2

CAS Name

Benzeneacetic acid, 4-[bis(2-chloroethyl)amino]-, (1,2-diethyl-1,2-ethanediyl)di-4,1-phenylene ester

Molecular Formula

C42H48Cl4N2O4

Molecular Mass

786.65

Cite this Page

Benzeneacetic acid, 4-[bis(2-chloroethyl)amino]-, (1,2-diethyl-1,2-ethanediyl)di-4,1-phenylene ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=19659-38-2 (retrieved 2024-11-22) (CAS RN: 19659-38-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C42H48Cl4N2O4/c1-3-39(33-9-17-37(18-10-33)51-41(49)29-31-5-13-35(14-6-31)47(25-21-43)26-22-44)40(4-2)34-11-19-38(20-12-34)52-42(50)30-32-7-15-36(16-8-32)48(27-23-45)28-24-46/h5-20,39-40H,3-4,21-30H2,1-2H3

InChIKey

InChIKey=GTWGWCYJKHSRHO-UHFFFAOYSA-N

SMILES

C(C(CC)C1=CC=C(OC(CC2=CC=C(N(CCCl)CCCl)C=C2)=O)C=C1)(CC)C3=CC=C(OC(CC4=CC=C(N(CCCl)CCCl)C=C4)=O)C=C3

Canonical SMILES

O=C(OC1=CC=C(C=C1)C(CC)C(C2=CC=C(OC(=O)CC3=CC=C(C=C3)N(CCCl)CCCl)C=C2)CC)CC4=CC=C(C=C4)N(CCCl)CCCl

Other Names for this Substance

  • Benzeneacetic acid, 4-[bis(2-chloroethyl)amino]-, (1,2-diethyl-1,2-ethanediyl)di-4,1-phenylene ester
  • Acetic acid, [p-[bis(2-chloroethyl)amino]phenyl]-, (1,2-diethylethylene)di-p-phenylene ester
  • Phenestrol

Deleted or Replaced CAS Registry Numbers

52597-19-0

CAS INSIGHTSTM
Targeted protein degrader structure, illustration