7-Chloro-1,3-dihydro-5-phenyl-2H-1,4-benzodiazepin-2-one-3-carboxylic acid ethyl ester

CAS Registry Number®

5606-55-3

CAS Name

7-Chloro-1,3-dihydro-5-phenyl-2H-1,4-benzodiazepin-2-one-3-carboxylic acid ethyl ester

Molecular Formula

C18H15ClN2O3

Molecular Mass

342.78

Cite this Page

7-Chloro-1,3-dihydro-5-phenyl-2H-1,4-benzodiazepin-2-one-3-carboxylic acid ethyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=5606-55-3 (retrieved 2024-11-22) (CAS RN: 5606-55-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    244 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C18H15ClN2O3/c1-2-24-18(23)16-17(22)20-14-9-8-12(19)10-13(14)15(21-16)11-6-4-3-5-7-11/h3-10,16H,2H2,1H3,(H,20,22)

InChIKey

InChIKey=DTKOQJNQMOCKQU-UHFFFAOYSA-N

SMILES

C(OCC)(=O)C1N=C(C=2C(NC1=O)=CC=C(Cl)C2)C3=CC=CC=C3

Canonical SMILES

O=C(OCC)C1N=C(C=2C=CC=CC2)C=3C=C(Cl)C=CC3NC1=O

Other Names for this Substance

  • 1H-1,4-Benzodiazepine-3-carboxylic acid, 7-chloro-2,3-dihydro-2-oxo-5-phenyl-, ethyl ester
  • 7-Chloro-1,3-dihydro-5-phenyl-2H-1,4-benzodiazepin-2-one-3-carboxylic acid ethyl ester

Deleted or Replaced CAS Registry Numbers

91547-32-9

CAS INSIGHTSTM
Targeted protein degrader structure, illustration