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Substance Name: 4-Isoxazolecarboxylic acid, 5-methyl-3-(5-nitro-2-furyl)-, butyl ester
RN: 22996-59-4
InChIKey: LQGYTNCCLAHTEJ-UHFFFAOYSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C13-H14-N2-O6

Molecular Weight

  • 294.262
 
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Names and Synonyms

Synonym

  • 5-Methyl-3-(5-nitro-2-furyl)-4-isoxazolecarboxylic acid butyl ester

Systematic Name

  • 4-Isoxazolecarboxylic acid, 5-methyl-3-(5-nitro-2-furyl)-, butyl ester

Registry Numbers

CAS Registry Number

  • 22996-59-4

System Generated Number

  • 0022996594

Structure Descriptors

InChI

1S/C13H14N2O6/c1-3-4-7-19-13(16)11-8(2)21-14-12(11)9-5-6-10(20-9)15(17)18/h5-6H,3-4,7H2,1-2H3

InChIKey

LQGYTNCCLAHTEJ-UHFFFAOYSA-N

Smiles

c1(c(C(OCCCC)=O)c(C)on1)c1oc([N+](=O)[O-])cc1