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Substance Name: Benzoic acid, 4-(((diethoxyphosphinyl)-3-pyridinylmethyl)amino)-, ethyl ester
RN: 160092-82-0
InChIKey: KLXURWYNYXIAPD-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H25-N2-O5-P

Molecular Weight

  • 392.3895
 
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Names and Synonyms

Synonym

  • Ethyl 4-(((diethoxyphosphinyl)-3-pyridinylmethyl)amino)benzoate

Systematic Name

  • Benzoic acid, 4-(((diethoxyphosphinyl)-3-pyridinylmethyl)amino)-, ethyl ester

Registry Numbers

CAS Registry Number

  • 160092-82-0

Other Registry Number

  • 182228-03-1

System Generated Number

  • 0160092820

Structure Descriptors

InChI

1S/C19H25N2O5P/c1-4-24-19(22)15-9-11-17(12-10-15)21-18(16-8-7-13-20-14-16)27(23,25-5-2)26-6-3/h7-14,18,21H,4-6H2,1-3H3

InChIKey

KLXURWYNYXIAPD-UHFFFAOYSA-N

Smiles

CCOC(=O)c1ccc(cc1)NC(c2cccnc2)P(=O)(OCC)OCC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 1500mg/kg (1500mg/kg)   Pharmaceutical Chemistry Journal Vol. 30, Pg. 465, 1996.