1,2-Dihydro-4-(2-hydroxyethyl)-5-methyl-1-(4-nitrobenzoyl)-3H-pyrazol-3-one

CAS Registry Number®

860611-87-6
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CAS Name

1,2-Dihydro-4-(2-hydroxyethyl)-5-methyl-1-(4-nitrobenzoyl)-3H-pyrazol-3-one

Molecular Formula

C13H13N3O5

Molecular Mass

291.26

Cite this Page

1,2-Dihydro-4-(2-hydroxyethyl)-5-methyl-1-(4-nitrobenzoyl)-3H-pyrazol-3-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=860611-87-6 (retrieved 2024-08-25) (CAS RN: 860611-87-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H13N3O5/c1-8-11(6-7-17)12(18)14-15(8)13(19)9-2-4-10(5-3-9)16(20)21/h2-5,17H,6-7H2,1H3,(H,14,18)

InChIKey

InChIKey=NLHGCQFWICPVCN-UHFFFAOYSA-N

SMILES

C(=O)(N1C(C)=C(CCO)C(=O)N1)C2=CC=C(N(=O)=O)C=C2

Canonical SMILES

O=C1NN(C(=O)C2=CC=C(C=C2)N(=O)=O)C(=C1CCO)C

Other Names for this Substance

  • 3H-Pyrazol-3-one, 1,2-dihydro-4-(2-hydroxyethyl)-5-methyl-1-(4-nitrobenzoyl)-
  • 1,2-Dihydro-4-(2-hydroxyethyl)-5-methyl-1-(4-nitrobenzoyl)-3H-pyrazol-3-one