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Substance Name: Phenethylamine, N-ethyl-N-(6-hydroxyhexyl)-4-methoxy-alpha-methyl-, 3,4- dimethoxybenzoate (ester)
RN: 67293-37-2
InChIKey: VWBGYBVUPUPFET-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C27-H39-N-O5

Molecular Weight

  • 457.6071
 
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Names and Synonyms

Synonyms

  • BRN 2786837
  • N-Ethyl-N-(6-hydroxyhexyl)-4-methoxy-alpha-methylphenethylamine 3,4-dimethoxybenzoate

Systematic Name

  • Phenethylamine, N-ethyl-N-(6-hydroxyhexyl)-4-methoxy-alpha-methyl-, 3,4- dimethoxybenzoate (ester)

Registry Numbers

CAS Registry Number

  • 67293-37-2

System Generated Number

  • 0067293372

Structure Descriptors

InChI

1S/C27H39NO5/c1-6-28(21(2)19-22-11-14-24(30-3)15-12-22)17-9-7-8-10-18-33-27(29)23-13-16-25(31-4)26(20-23)32-5/h11-16,20-21H,6-10,17-19H2,1-5H3

InChIKey

VWBGYBVUPUPFET-UHFFFAOYSA-N

Smiles

CCN(CCCCCCOC(=O)c1ccc(c(c1)OC)OC)C(C)Cc2ccc(cc2)OC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 200mg/kg (200mg/kg)   Journal of Medicinal Chemistry. Vol. 6, Pg. 97, 1963.