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Substance Name: 4-Piperidinone, 1-((2,3-dihydro-2-(4-methoxyphenyl)-6-nitro-3-oxo-1H-isoindol-1-yl)acetyl)-
RN: 103255-62-5
InChIKey: IBFXBHZGYWAXKI-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H21-N3-O6

Molecular Weight

  • 423.4229
 
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Names and Synonyms

Synonym

  • 1-((2,3-Dihydro-2-(4-methoxyphenyl)-6-nitro-3-oxo-1H-isoindol-1-yl)acetyl)-4-piperidinone

Systematic Name

  • 4-Piperidinone, 1-((2,3-dihydro-2-(4-methoxyphenyl)-6-nitro-3-oxo-1H-isoindol-1-yl)acetyl)-

Registry Numbers

CAS Registry Number

  • 103255-62-5

System Generated Number

  • 0103255625

Structure Descriptors

InChI

1S/C22H21N3O6/c1-31-17-5-2-14(3-6-17)24-20(13-21(27)23-10-8-16(26)9-11-23)19-12-15(25(29)30)4-7-18(19)22(24)28/h2-7,12,20H,8-11,13H2,1H3

InChIKey

IBFXBHZGYWAXKI-UHFFFAOYSA-N

Smiles

N1(CCC(CC1)=O)C(=O)C[C@@H]1N(C(c2ccc(cc12)[N+](=O)[O-])=O)c1ccc(cc1)OC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LDLo oral 1gm/kg (1000mg/kg)   United States Patent Document. Vol. #4695572,