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Chemistry, part 3

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > kpt-276

Preferred term

kpt-276  

Type

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

Broader concept

charge

  • 0

formula

  • C16H10F8N4O

has_role

inchi

  • InChI=1S/C16H10F8N4O/c17-14(18)6-27(7-14)12(29)1-2-28-8-25-13(26-28)9-3-10(15(19,20)21)5-11(4-9)16(22,23)24/h1-5,8H,6-7H2/b2-1-

inchikey

  • JCHAWRDHMUSLMM-UPHRSURJSA-N

mass

  • 426.270

monoisotopicmass

  • 426.07269

smiles

  • C(/[H])(=C(/[H])/N1C=NC(C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)=N1)/C(N3CC(C3)(F)F)=O

subset

  • 2_STAR

synonym EXACT

  • (Z)-3-[3-[3,5-bis(trifluoromethyl)phenyl]-1,2,4-triazol-1-yl]-1-(3,3-difluoroazetidin-1-yl)prop-2-en-1-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:232870

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