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Substance Name: Piperazinone, 3-(2-(4-nitrophenyl)-2-oxoethylidene)-1-phenyl-
RN: 178408-29-2
InChIKey: SGLQWAOXTIJVEJ-VBKFSLOCSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H15-N3-O4

Molecular Weight

  • 337.3335
 
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Names and Synonyms

Synonym

  • 3-(2-(4-Nitrophenyl)-2-oxoethylidene)-1-phenylpiperazinone

Systematic Name

  • Piperazinone, 3-(2-(4-nitrophenyl)-2-oxoethylidene)-1-phenyl-

Registry Numbers

CAS Registry Number

  • 178408-29-2

System Generated Number

  • 0178408292

Structure Descriptors

InChI

1S/C18H15N3O4/c22-17(13-6-8-15(9-7-13)21(24)25)12-16-18(23)20(11-10-19-16)14-4-2-1-3-5-14/h1-9,12,19H,10-11H2/b16-12-

InChIKey

SGLQWAOXTIJVEJ-VBKFSLOCSA-N

Smiles

c1ccc(cc1)N2CCN/C(=C\C(=O)c3ccc(cc3)[N+](=O)[O-])/C2=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   Pharmaceutical Chemistry Journal Vol. 30, Pg. 186, 1996.