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Substance Name: Carbamic acid, propionyl-, 2-ethyl-2-propyltrimethylene ester
RN: 25648-89-9
InChIKey: QXSLXBABKHUIOW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H28-N2-O6

Molecular Weight

  • 344.405
 
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Names and Synonyms

Synonyms

  • BRN 3000820
  • Propionylcarbamic acid 2-ethyl-2-propyltrimethylene ester

Systematic Name

  • Carbamic acid, propionyl-, 2-ethyl-2-propyltrimethylene ester

Registry Numbers

CAS Registry Number

  • 25648-89-9

System Generated Number

  • 0025648899

Structure Descriptors

InChI

1S/C16H28N2O6/c1-6-11(9-23-15(21)17-12(19)7-2)14(10(4)5)24-16(22)18-13(20)8-3/h10-11,14H,6-9H2,1-5H3,(H,17,19,21)(H,18,20,22)

InChIKey

QXSLXBABKHUIOW-UHFFFAOYSA-N

Smiles

C([C@@H]([C@@H](C(C)C)OC(NC(=O)CC)=O)CC)OC(NC(=O)CC)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 1400mg/kg (1400mg/kg) AUTONOMIC NERVOUS SYSTEM: "SMOOTH MUSCLE RELAXANT (MECHANISM UNDEFINED, SPASMOLYTIC)" Journal of Medicinal Chemistry. Vol. 12, Pg. 462, 1969.