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Substance Name: Benzenepropanoic acid, alpha-cyano-4-nitro-, ethyl ester
ID: DA83432800
InChIKey: PMIHMBXZTOSETH-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H12-N2-O4

Molecular Weight

  • 248.2368
 
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Names and Synonyms

Synonyms

  • Ethyl alpha-cyano-4-nitrobenzenepropanoate
  • Hydrocinnamic acid, alpha-cyano-4-nitro-, ethyl ester

Systematic Name

  • Benzenepropanoic acid, alpha-cyano-4-nitro-, ethyl ester

Registry Numbers

ID Number

  • NIOSH/DA8343280

System Generated Number

  • DA83432800

Structure Descriptors

InChI

1S/C12H12N2O4/c1-2-18-12(15)10(8-13)7-9-3-5-11(6-4-9)14(16)17/h3-6,10H,2,7H2,1H3

InChIKey

PMIHMBXZTOSETH-UHFFFAOYSA-N

Smiles

CCOC(=O)C(Cc1ccc(cc1)[N+](=O)[O-])C#N