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Concept information

... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > (3-bromophenyl)-[5-(4-bromophenyl)-3-ethyl-5-hydroxy-4h-pyrazol-1-yl]methanone
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > halide > organohalogen compound > (3-bromophenyl)-[5-(4-bromophenyl)-3-ethyl-5-hydroxy-4h-pyrazol-1-yl]methanone
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > halogen molecular entity > halide > organohalogen compound > (3-bromophenyl)-[5-(4-bromophenyl)-3-ethyl-5-hydroxy-4h-pyrazol-1-yl]methanone

Preferred term

(3-bromophenyl)-[5-(4-bromophenyl)-3-ethyl-5-hydroxy-4h-pyrazol-1-yl]methanone  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

charge

  • 0

formula

  • C18H16Br2N2O2

inchi

  • InChI=1S/C18H16Br2N2O2/c1-2-16-11-18(24,13-6-8-14(19)9-7-13)22(21-16)17(23)12-4-3-5-15(20)10-12/h3-10,24H,2,11H2,1H3

inchikey

  • OHNDUBYZFBHKOY-UHFFFAOYSA-N

mass

  • 452.140

monoisotopicmass

  • 449.95785

smiles

  • CCC1=NN(C(C1)(C2=CC=C(C=C2)Br)O)C(=O)C3=CC(=CC=C3)Br

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:113050

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