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Substance Name: 3-Pyridinecarboxylic acid, 1,4-dihydro-5-(1-(butoxyimino)ethyl)-2,6-dimethyl-4-(3-nitrophenyl)-, methyl ester
RN: 89541-43-5
InChIKey: NEIPIPPBCDNKHT-SSDVNMTOSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H27-N3-O5

Molecular Weight

  • 401.4603
 
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Names and Synonyms

  • 3-Pyridinecarboxylic acid, 1,4-dihydro-5-(1-(butoxyimino)ethyl)-2,6-dimethyl-4-(3-nitrophenyl)-, methyl ester

Registry Numbers

CAS Registry Number

  • 89541-43-5

System Generated Number

  • 0089541435

Structure Descriptors

InChI

1S/C21H27N3O5/c1-5-6-12-29-22-11-10-18-14(2)23-15(3)19(21(25)28-4)20(18)16-8-7-9-17(13-16)24(26)27/h7-9,11,13,18,20H,5-6,10,12H2,1-4H3/b22-11+

InChIKey

NEIPIPPBCDNKHT-SSDVNMTOSA-N

Smiles

CCCCO\N=C\CC1C(C(=C(C)N=C1C)C(=O)OC)c2cccc(c2)[N+](=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 37500ug/kg (37.5mg/kg)   Farmaco, Edizione Scientifica. Vol. 42, Pg. 697, 1987.