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Substance Name: 2(3H)-Benzoxazolone, 6-(4-nitrobenzoyl)-3-(1-piperidinylmethyl)-
RN: 99541-46-5
InChIKey: CPQVTWKYWCJRNK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H19-N3-O5

Molecular Weight

  • 381.3861
 
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Names and Synonyms

Synonym

  • 6-(4-Nitrobenzoyl)-3-(1-piperidinylmethyl)-2(3H)-benzoxazolone

Systematic Name

  • 2(3H)-Benzoxazolone, 6-(4-nitrobenzoyl)-3-(1-piperidinylmethyl)-

Registry Numbers

CAS Registry Number

  • 99541-46-5

System Generated Number

  • 0099541465

Structure Descriptors

InChI

1S/C20H19N3O5/c24-19(14-4-7-16(8-5-14)23(26)27)15-6-9-17-18(12-15)28-20(25)22(17)13-21-10-2-1-3-11-21/h4-9,12H,1-3,10-11,13H2

InChIKey

CPQVTWKYWCJRNK-UHFFFAOYSA-N

Smiles

c1cc(ccc1C(=O)c2ccc3c(c2)oc(=O)n3CN4CCCCC4)[N+](=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 1gm/kg (1000mg/kg)   Farmaco. Vol. 49, Pg. 663, 1994.