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Substance Name: 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-4-(3-nitrophenyl)-1,2,6-trimethyl-, ethyl methyl ester
RN: 50698-12-9
InChIKey: HHWSTZALTBWGPQ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H22-N2-O6

Molecular Weight

  • 374.3908
 
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Names and Synonyms

Synonym

  • Ethyl methyl 1,2,6-trimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate

Systematic Name

  • 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-4-(3-nitrophenyl)-1,2,6-trimethyl-, ethyl methyl ester

Registry Numbers

CAS Registry Number

  • 50698-12-9

System Generated Number

  • 0050698129

Structure Descriptors

InChI

1S/C19H22N2O6/c1-6-27-19(23)16-12(3)20(4)11(2)15(18(22)26-5)17(16)13-8-7-9-14(10-13)21(24)25/h7-10,17H,6H2,1-5H3

InChIKey

HHWSTZALTBWGPQ-UHFFFAOYSA-N

Smiles

CCOC(=O)C1=C(N(C(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 3gm/kg (3000mg/kg)   United States Patent Document. Vol. #3920823,