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Substance Name: Imidazole-5-carboxylic acid, 1-(alpha-methylbenzyl)-, 1-methyl-3-piperidyl ester
RN: 101976-68-5
InChIKey: MICDDWULTVVSES-UHFFFAOYSA-N

Molecular Formula

  • C18-H23-N3-O2

Molecular Weight

  • 313.3987
 
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Names and Synonyms

Synonym

  • 1-(alpha-Methylbenzyl)imidazole-5-carboxylic acid, ester with 1-methylpiperidin-3-ol

Systematic Name

  • Imidazole-5-carboxylic acid, 1-(alpha-methylbenzyl)-, 1-methyl-3-piperidyl ester

Registry Numbers

CAS Registry Number

  • 101976-68-5

System Generated Number

  • 0101976685

Structure Descriptors

InChI

1S/C18H23N3O2/c1-14(15-7-4-3-5-8-15)21-13-19-11-17(21)18(22)23-16-9-6-10-20(2)12-16/h3-5,7-8,11,13-14,16H,6,9-10,12H2,1-2H3

InChIKey

MICDDWULTVVSES-UHFFFAOYSA-N

Smiles

CC(c1ccccc1)n2cncc2C(=O)OC3CCCN(C3)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 100mg/kg (100mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#09371,