(3S,4aS,6S,8aR)-6-[3-Chloro-2-(2H-tetrazol-5-yl)phenoxy]decahydro-3-isoquinolinecarboxylic acid

CAS Registry Number®

503294-13-1

CAS Name

(3S,4aS,6S,8aR)-6-[3-Chloro-2-(2H-tetrazol-5-yl)phenoxy]decahydro-3-isoquinolinecarboxylic acid

Molecular Formula

C17H20ClN5O3

Molecular Mass

377.83

Cite this Page

(3S,4aS,6S,8aR)-6-[3-Chloro-2-(2H-tetrazol-5-yl)phenoxy]decahydro-3-isoquinolinecarboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=503294-13-1 (retrieved 2024-11-22) (CAS RN: 503294-13-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C17H20ClN5O3/c18-12-2-1-3-14(15(12)16-20-22-23-21-16)26-11-5-4-9-8-19-13(17(24)25)7-10(9)6-11/h1-3,9-11,13,19H,4-8H2,(H,24,25)(H,20,21,22,23)/t9-,10+,11-,13-/m0/s1

InChIKey

InChIKey=LAKQPSQCICNZII-NOHGZBONSA-N

SMILES

O(C1=C(C(Cl)=CC=C1)C=2NN=NN2)[C@@H]3C[C@]4([C@@](CC3)(CN[C@H](C(O)=O)C4)[H])[H]

Canonical SMILES

O=C(O)C1NCC2CCC(OC=3C=CC=C(Cl)C3C4=NN=NN4)CC2C1

Other Names for this Substance

  • 3-Isoquinolinecarboxylic acid, 6-[3-chloro-2-(2H-tetrazol-5-yl)phenoxy]decahydro-, (3S,4aS,6S,8aR)-
  • 3-Isoquinolinecarboxylic acid, 6-[3-chloro-2-(1H-tetrazol-5-yl)phenoxy]decahydro-, (3S,4aS,6S,8aR)-
  • (3S,4aS,6S,8aR)-6-[3-Chloro-2-(2H-tetrazol-5-yl)phenoxy]decahydro-3-isoquinolinecarboxylic acid
  • Dasolampanel

CAS INSIGHTSTM
Targeted protein degrader structure, illustration