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Substance Name: 3-alpha-Tropanol, 2,3,3-triphenylpropionate
RN: 20811-73-8
InChIKey: QOTYPDRQKBVTFO-UHFFFAOYSA-N

Molecular Formula

  • C29-H31-N-O2

Molecular Weight

  • 425.569
 
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Names and Synonyms

Synonyms

  • 2,3,3-Triphenylpropionic acid 3-alpha-tropanyl ester
  • Propionic acid, 2,3,3-triphenyl-, 3-alpha-tropanyl ester

Systematic Name

  • 3-alpha-Tropanol, 2,3,3-triphenylpropionate

Registry Numbers

CAS Registry Number

  • 20811-73-8

System Generated Number

  • 0020811738

Structure Descriptors

InChI

1S/C29H31NO2/c1-30-24-17-18-25(30)20-26(19-24)32-29(31)28(23-15-9-4-10-16-23)27(21-11-5-2-6-12-21)22-13-7-3-8-14-22/h2-16,24-28H,17-20H2,1H3

InChIKey

QOTYPDRQKBVTFO-UHFFFAOYSA-N

Smiles

c1(ccccc1)C([C@@H](C(=O)OC1C[C@@H]2CC[C@@H](C1)N2C)c1ccccc1)c1ccccc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 42mg/kg (42mg/kg)   Russian Pharmacology and Toxicology Vol. 32, Pg. 24, 1969.