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Substance Name: 3-Piperidinecarboxylic acid, 1-(2-(1,3-dioxan-2-ylethyl)-4-(1-oxopropyl)phenylamino)-, methyl ester
RN: 156724-47-9
InChIKey: DJGAUJIDNAGYMR-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H32-N2-O5

Molecular Weight

  • 404.5038
 
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Names and Synonyms

Synonym

  • Methyl 1-(2-(1,3-dioxan-2-yl)ethyl)-4-((1-oxopropyl)phenylamino)-3-piperidinecarboxylate

Systematic Name

  • 3-Piperidinecarboxylic acid, 1-(2-(1,3-dioxan-2-ylethyl)-4-(1-oxopropyl)phenylamino)-, methyl ester

Registry Numbers

CAS Registry Number

  • 156724-47-9

System Generated Number

  • 0156724479

Structure Descriptors

InChI

1S/C22H32N2O5/c1-3-20(25)24(17-8-5-4-6-9-17)19-10-12-23(16-18(19)22(26)27-2)13-11-21-28-14-7-15-29-21/h4-6,8-9,18-19,21H,3,7,10-16H2,1-2H3

InChIKey

DJGAUJIDNAGYMR-UHFFFAOYSA-N

Smiles

CCC(=O)N(C1CCN(CCC2OCCCO2)CC1C(=O)OC)c3ccccc3

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rabbit LD50 intravenous 430ug/kg (0.43mg/kg)   Zhongguo Yaoke Daxue Xuebao. Journal of China Pharmaceutical University. Vol. 25, Pg. 1, 1994.