Nizofenone

CAS Registry Number®

54533-85-6
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CAS Name

Nizofenone

Molecular Formula

C21H21ClN4O3

Molecular Mass

412.87

Cite this Page

Nizofenone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=54533-85-6 (retrieved 2024-04-23) (CAS RN: 54533-85-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    75-76 °C

Source(s)

  • (1) Drugs - Synonyms and Properties data were obtained from Ashgate Publishing Co. (US)

Other Names and Identifiers

InChI

InChI=1S/C21H21ClN4O3/c1-3-24(4-2)14-20-23-11-12-25(20)19-10-9-15(26(28)29)13-17(19)21(27)16-7-5-6-8-18(16)22/h5-13H,3-4,14H2,1-2H3

InChIKey

InChIKey=WZGBZLHGOVJDET-UHFFFAOYSA-N

SMILES

C(=O)(C1=C(C=CC(N(=O)=O)=C1)N2C(CN(CC)CC)=NC=C2)C3=C(Cl)C=CC=C3

Canonical SMILES

O=C(C=1C=CC=CC1Cl)C2=CC(=CC=C2N3C=CN=C3CN(CC)CC)N(=O)=O

Other Names for this Substance

  • Methanone, (2-chlorophenyl)[2-[2-[(diethylamino)methyl]-1H-imidazol-1-yl]-5-nitrophenyl]-
  • (2-Chlorophenyl)[2-[2-[(diethylamino)methyl]-1H-imidazol-1-yl]-5-nitrophenyl]methanone
  • 1-[2-(2-Chlorobenzoyl)-4-nitrophenyl]-2-[(diethylamino)methyl]imidazole
  • Nizofenone

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