rel-(3R,4aS,6R,8aS)-Decahydro-6-(2H-tetrazol-5-ylmethyl)-3-isoquinolinecarboxylic acid

CAS Registry Number®

143343-70-8
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CAS Name

rel-(3R,4aS,6R,8aS)-Decahydro-6-(2H-tetrazol-5-ylmethyl)-3-isoquinolinecarboxylic acid

Molecular Formula

C12H19N5O2

Molecular Mass

265.31

Cite this Page

rel-(3R,4aS,6R,8aS)-Decahydro-6-(2H-tetrazol-5-ylmethyl)-3-isoquinolinecarboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=143343-70-8 (retrieved 2024-09-19) (CAS RN: 143343-70-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1/C12H19N5O2/c18-12(19)10-5-9-3-7(1-2-8(9)6-13-10)4-11-14-16-17-15-11/h7-10,13H,1-6H2,(H,18,19)(H,14,15,16,17)/t7-,8-,9+,10-/s2

InChIKey

InChIKey=ACTONBBIVMTUAJ-TZFXTEPQNA-N

SMILES

C([C@H]1C[C@@]2([C@](CC1)(CN[C@@H](C(O)=O)C2)[H])[H])C=3NN=NN3

Canonical SMILES

O=C(O)C1NCC2CCC(CC3=NN=NN3)CC2C1

Other Names for this Substance

  • 3-Isoquinolinecarboxylic acid, decahydro-6-(2H-tetrazol-5-ylmethyl)-, (3R,4aS,6R,8aS)-rel-
  • 3-Isoquinolinecarboxylic acid, decahydro-6-(1H-tetrazol-5-ylmethyl)-, (3α,4aα,6β,8aα)-(±)-
  • 3-Isoquinolinecarboxylic acid, decahydro-6-(1H-tetrazol-5-ylmethyl)-, (3R,4aS,6R,8aS)-rel-
  • rel-(3R,4aS,6R,8aS)-Decahydro-6-(2H-tetrazol-5-ylmethyl)-3-isoquinolinecarboxylic acid
  • LY 202157

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