1,5-Dimethyl 2,4-diacetyl-3-(3-nitrophenyl)pentanedioate

CAS Registry Number®

89080-61-5
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CAS Name

1,5-Dimethyl 2,4-diacetyl-3-(3-nitrophenyl)pentanedioate

Molecular Formula

C17H19NO8

Molecular Mass

365.33

Cite this Page

1,5-Dimethyl 2,4-diacetyl-3-(3-nitrophenyl)pentanedioate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=89080-61-5 (retrieved 2024-06-29) (CAS RN: 89080-61-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C17H19NO8/c1-9(19)13(16(21)25-3)15(14(10(2)20)17(22)26-4)11-6-5-7-12(8-11)18(23)24/h5-8,13-15H,1-4H3

InChIKey

InChIKey=NRZGJFOHXKPBOS-UHFFFAOYSA-N

SMILES

C(C(C(OC)=O)C(C)=O)(C(C(OC)=O)C(C)=O)C1=CC(N(=O)=O)=CC=C1

Canonical SMILES

O=C(OC)C(C(=O)C)C(C=1C=CC=C(C1)N(=O)=O)C(C(=O)OC)C(=O)C

Other Names for this Substance

  • Pentanedioic acid, 2,4-diacetyl-3-(3-nitrophenyl)-, 1,5-dimethyl ester
  • Pentanedioic acid, 2,4-diacetyl-3-(3-nitrophenyl)-, dimethyl ester
  • 1,5-Dimethyl 2,4-diacetyl-3-(3-nitrophenyl)pentanedioate