2-[4-(4-Hydroxy-2-butyn-1-yl)-1-piperazinyl]-3-nitrobenzoic acid

CAS Registry Number®

374063-97-5

CAS Name

2-[4-(4-Hydroxy-2-butyn-1-yl)-1-piperazinyl]-3-nitrobenzoic acid

Molecular Formula

C15H17N3O5

Molecular Mass

319.31

Cite this Page

2-[4-(4-Hydroxy-2-butyn-1-yl)-1-piperazinyl]-3-nitrobenzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=374063-97-5 (retrieved 2024-11-22) (CAS RN: 374063-97-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C15H17N3O5/c19-11-2-1-6-16-7-9-17(10-8-16)14-12(15(20)21)4-3-5-13(14)18(22)23/h3-5,19H,6-11H2,(H,20,21)

InChIKey

InChIKey=WRELIIJZMKMRMP-UHFFFAOYSA-N

SMILES

C(O)(=O)C1=C(C(N(=O)=O)=CC=C1)N2CCN(CC#CCO)CC2

Canonical SMILES

O=C(O)C1=CC=CC(=C1N2CCN(CC#CCO)CC2)N(=O)=O

Other Names for this Substance

  • Benzoic acid, 2-[4-(4-hydroxy-2-butyn-1-yl)-1-piperazinyl]-3-nitro-
  • Benzoic acid, 2-[4-(4-hydroxy-2-butynyl)-1-piperazinyl]-3-nitro-
  • 2-[4-(4-Hydroxy-2-butyn-1-yl)-1-piperazinyl]-3-nitrobenzoic acid

CAS INSIGHTSTM
Targeted protein degrader structure, illustration