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Substance Name: beta-Alanine, N-(5-(2-chloro-4-(trifluoromethyl)phenoxy)-2-nitrophenyl)-, methyl ester
RN: 86169-45-1
InChIKey: FBBHAWNHHLSOQP-UHFFFAOYSA-N

Molecular Weight

  • 418.7536
 
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Names and Synonyms

  • beta-Alanine, N-(5-(2-chloro-4-(trifluoromethyl)phenoxy)-2-nitrophenyl)-, methyl ester

Registry Numbers

CAS Registry Number

  • 86169-45-1

System Generated Number

  • 0086169451

Structure Descriptors

InChI

1S/C17H14ClF3N2O5/c1-27-16(24)6-7-22-13-9-11(3-4-14(13)23(25)26)28-15-5-2-10(8-12(15)18)17(19,20)21/h2-5,8-9,22H,6-7H2,1H3

InChIKey

FBBHAWNHHLSOQP-UHFFFAOYSA-N

Smiles

C(=O)(CCNc1c([N+](=O)[O-])ccc(c1)Oc1c(cc(C(F)(F)F)cc1)Cl)OC