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Substance Name: Atroscine hydrobromide
RN: 672-21-9
UNII: 1BT935HYHI
InChIKey: WTGQALLALWYDJH-XMCURJOZSA-N

Molecular Formula

  • C17-H21-N-O4.Br-H

Molecular Weight

  • 384.2678
 
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Names and Synonyms

Name of Substance

  • Atroscine hydrobromide

Synonyms

  • EINECS 211-591-1
  • UNII-1BT935HYHI

Systematic Name

  • (1alpha,2beta,4beta,5alpha,7beta)-(1)-9-Methyl-3-oxa-9-azatricyclo(3.3.1.02,4)non-7-yl (hydroxymethyl)phenylacetate hydrochloride

Registry Numbers

CAS Registry Number

  • 672-21-9

FDA UNII

  • 1BT935HYHI

System Generated Number

  • 0000672219

Molecular Formulas

Molecular Formula

  • C17-H21-N-O4.Br-H

Molecular Formula Fragments

  • Br-H
  • C17-H21-N-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C17H21NO4.BrH/c1-18-13-7-11(8-14(18)16-15(13)22-16)21-17(20)12(9-19)10-5-3-2-4-6-10;/h2-6,11-16,19H,7-9H2,1H3;1H/t11-,12?,13-,14+,15-,16+;

InChIKey

WTGQALLALWYDJH-XMCURJOZSA-N

Smiles

CN1[C@@H]2C[C@H](C[C@H]1[C@H]3[C@@H]2O3)OC(=O)C(CO)c4ccccc4.Br