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Substance Name: Benzenepropanoic acid, alpha-cyano-alpha-ethyl-2-nitro-, ethyl ester
ID: DA83432600
InChIKey: UDQOPSBUNAXEOS-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H16-N2-O4

Molecular Weight

  • 276.2904
 
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Names and Synonyms

Synonyms

  • Ethyl alpha-cyano-alpha-ethyl-2-nitrobenzenepropanoate
  • Hydrocinnamic acid, alpha-cyano-alpha-ethyl-2-nitro-, ethyl ester

Systematic Name

  • Benzenepropanoic acid, alpha-cyano-alpha-ethyl-2-nitro-, ethyl ester

Registry Numbers

ID Number

  • NIOSH/DA8343260

System Generated Number

  • DA83432600

Structure Descriptors

InChI

1S/C14H16N2O4/c1-3-14(10-15,13(17)20-4-2)9-11-7-5-6-8-12(11)16(18)19/h5-8H,3-4,9H2,1-2H3

InChIKey

UDQOPSBUNAXEOS-UHFFFAOYSA-N

Smiles

CCOC(=O)C(CC)(Cc1ccccc1[N+](=O)[O-])C#N