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Substance Name: 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,6-dimethyl-1-(ethoxyphenyl)-4-(3-nitrophenyl)-, diethyl ester
RN: 89467-87-8
InChIKey: RAPBWVAVONLHDH-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C27-H30-N2-O7

Molecular Weight

  • 494.541
 
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Names and Synonyms

Synonym

  • Diethyl 2,6-dimethyl-1-(ethoxyphenyl)-4-(3-nitrophenyl)-1,4-dihydro-3,5-pyridinedicarboxylate

Systematic Name

  • 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,6-dimethyl-1-(ethoxyphenyl)-4-(3-nitrophenyl)-, diethyl ester

Registry Numbers

CAS Registry Number

  • 89467-87-8

System Generated Number

  • 0089467878

Structure Descriptors

InChI

1S/C27H30N2O7/c1-6-34-22-15-10-9-14-21(22)28-17(4)23(26(30)35-7-2)25(24(18(28)5)27(31)36-8-3)19-12-11-13-20(16-19)29(32)33/h9-16,25H,6-8H2,1-5H3

InChIKey

RAPBWVAVONLHDH-UHFFFAOYSA-N

Smiles

CCOc1ccccc1N2C(=C(C(C(=C2C)C(=O)OCC)c3cccc(c3)[N+](=O)[O-])C(=O)OCC)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 3gm/kg (3000mg/kg)   Pharmaceutical Chemistry Journal Vol. 18, Pg. 23, 1984.