Methscopolamine nitrate

CAS Registry Number®

6106-46-3

CAS Name

Methscopolamine nitrate

Molecular Formula

C18H24NO4.NO3

Cite this Page

Methscopolamine nitrate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=6106-46-3 (retrieved 2024-11-22) (CAS RN: 6106-46-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C18H24NO4.NO3/c1-19(2)14-8-12(9-15(19)17-16(14)23-17)22-18(21)13(10-20)11-6-4-3-5-7-11;2-1(3)4/h3-7,12-17,20H,8-10H2,1-2H3;/q+1;-1/t12-,13-,14-,15+,16-,17+;/m1./s1

InChIKey

InChIKey=BSQIVYOSLFLSGE-RAFJPFSSSA-N

SMILES

N(=O)(=O)[O-].C[N+]1(C)[C@@]2([C@]3([C@](O3)([C@]1(C[C@@H](OC([C@H](CO)C4=CC=CC=C4)=O)C2)[H])[H])[H])[H]

Canonical SMILES

O=C(OC1CC2C3OC3C(C1)[N+]2(C)C)C(C=4C=CC=CC4)CO.O=N(=O)[O-]

Other Names for this Substance

  • 3-Oxa-9-azoniatricyclo[3.3.1.02,4]nonane, 7-[(2S)-3-hydroxy-1-oxo-2-phenylpropoxy]-9,9-dimethyl-, (1α,2β,4β,5α,7β)-, nitrate (1:1)
  • 3-Oxa-9-azoniatricyclo[3.3.1.02,4]nonane, 7-(3-hydroxy-1-oxo-2-phenylpropoxy)-9,9-dimethyl-, [7(S)-(1α,2β,4β,5α,7β)]-, nitrate (salt)
  • 1αH,5αH-Tropanium, 6β,7β-epoxy-3α-hydroxy-8-methyl-, nitrate, (-)-tropate
  • N-Methylscopolammonium nitrate
  • 3-Oxa-9-azoniatricyclo[3.3.1.02,4]nonane, 7-[(2S)-3-hydroxy-1-oxo-2-phenylpropoxy]-9,9-dimethyl-, (1α,2β,4β,5α,7β)-, nitrate (salt)

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Deleted or Replaced CAS Registry Numbers

51-33-2, 7085-72-5, 16868-00-1, 51541-33-4

CAS INSIGHTSTM
Targeted protein degrader structure, illustration