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Concept information

Preferred term

3-hydroxy-5-nitro-2-phenyl-n-[1-(phenylmethyl)-4-piperidinyl]-4-triazolimine  

Type

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

Broader concept

charge

  • 0

formula

  • C20H22N6O3

inchi

  • InChI=1S/C20H22N6O3/c27-25-19(20(26(28)29)22-24(25)18-9-5-2-6-10-18)21-17-11-13-23(14-12-17)15-16-7-3-1-4-8-16/h1-10,17,27H,11-15H2

inchikey

  • VAKFYCHHUYCIJV-UHFFFAOYSA-N

mass

  • 394.428

monoisotopicmass

  • 394.17534

smiles

  • C1CN(CCC1N=C2C(=NN(N2O)C3=CC=CC=C3)[N+](=O)[O-])CC4=CC=CC=C4

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:116325

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