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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 > rtrd01

Preferred term

rtrd01  

Type

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

Broader concept

charge

  • 0

formula

  • C18H21FN4O2

inchi

  • InChI=1S/C18H21FN4O2/c19-14-4-2-13(3-5-14)8-18(12-24)6-1-7-23(11-18)16-10-21-9-15(22-16)17(20)25/h2-5,9-10,24H,1,6-8,11-12H2,(H2,20,25)

inchikey

  • MCTLSQYQBQKNRU-UHFFFAOYSA-N

mass

  • 344.390

monoisotopicmass

  • 344.16485

smiles

  • C1CC(CC2=CC=C(C=C2)F)(CN(C1)C3=CN=CC(C(=N)O)=N3)CO

subset

  • 2_STAR

synonym EXACT

  • 6-[3-[(4-fluorophenyl)methyl]-3-(hydroxymethyl)piperidin-1-yl]pyrazine-2-carboxamide

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:232954

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