8-Azabicyclo[3.2.1]octane-2-carboxylic acid, 3-(4-chlorophenyl)-8-methyl-, phenyl ester, hydrochloride (1:1), (1R,2S,3S,5S)-

CAS Registry Number®

141807-57-0
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CAS Name

8-Azabicyclo[3.2.1]octane-2-carboxylic acid, 3-(4-chlorophenyl)-8-methyl-, phenyl ester, hydrochloride (1:1), (1R,2S,3S,5S)-

Molecular Formula

C21H22ClNO2.ClH

Cite this Page

8-Azabicyclo[3.2.1]octane-2-carboxylic acid, 3-(4-chlorophenyl)-8-methyl-, phenyl ester, hydrochloride (1:1), (1R,2S,3S,5S)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=141807-57-0 (retrieved 2022-09-28) (CAS RN: 141807-57-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C21H22ClNO2.ClH/c1-23-16-11-12-19(23)20(21(24)25-17-5-3-2-4-6-17)18(13-16)14-7-9-15(22)10-8-14;/h2-10,16,18-20H,11-13H2,1H3;1H/t16-,18+,19+,20-;/m0./s1

InChIKey

InChIKey=UVNAYBAOZUMARC-TVEJVZOKSA-N

SMILES

C(OC1=CC=CC=C1)(=O)[C@H]2[C@H](C[C@H]3N(C)[C@@H]2CC3)C4=CC=C(Cl)C=C4.Cl

Canonical SMILES

Cl.O=C(OC=1C=CC=CC1)C2C(C3=CC=C(Cl)C=C3)CC4N(C)C2CC4

Other Names for this Substance

  • 8-Azabicyclo[3.2.1]octane-2-carboxylic acid, 3-(4-chlorophenyl)-8-methyl-, phenyl ester, hydrochloride (1:1), (1R,2S,3S,5S)-
  • 8-Azabicyclo[3.2.1]octane-2-carboxylic acid, 3-(4-chlorophenyl)-8-methyl-, phenyl ester, hydrochloride, [1R-(exo,exo)]-
  • 8-Azabicyclo[3.2.1]octane-2-carboxylic acid, 3-(4-chlorophenyl)-8-methyl-, phenyl ester, hydrochloride, (1R,2S,3S,5S)-
  • RTI 113
  • RTI 4229-113