skip to main content

Content language

Contact us: CRM@email.irandoc.ac.ir

Concept information

... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic aromatic compound > quinolines > 4-[4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl]-1h-quinolin-2-one
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic aromatic compound > quinolines > 4-[4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl]-1h-quinolin-2-one

Preferred term

4-[4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl]-1h-quinolin-2-one  

Type

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

Broader concept

charge

  • 0

formula

  • C21H18F3N3O2

inchi

  • InChI=1S/C21H18F3N3O2/c22-21(23,24)14-4-3-5-15(12-14)26-8-10-27(11-9-26)20(29)17-13-19(28)25-18-7-2-1-6-16(17)18/h1-7,12-13H,8-11H2,(H,25,28)

inchikey

  • NKHDYQSOEVSMNT-UHFFFAOYSA-N

mass

  • 401.389

monoisotopicmass

  • 401.13511

smiles

  • FC(F)(F)C1=CC(N2CCN(C(=O)C3=C4C(=NC(O)=C3)C=CC=C4)CC2)=CC=C1

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:149821

Download this concept: