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Chemistry, part 2

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Concept information

... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic aromatic compound > diarylmethane > cetirizine hydrochloride
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic aromatic compound > diarylmethane > cetirizine hydrochloride
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic aromatic compound > diarylmethane > cetirizine hydrochloride

Preferred term

cetirizine hydrochloride  

Type

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

Broader concept

charge

  • 0

formula

  • C21H25ClN2O3.2HCl
  • C21H27Cl3N2O3

inchi

  • InChI=1S/C21H25ClN2O3.2ClH/c22-19-8-6-18(7-9-19)21(17-4-2-1-3-5-17)24-12-10-23(11-13-24)14-15-27-16-20(25)26;;/h1-9,21H,10-16H2,(H,25,26);2*1H

inchikey

  • PGLIUCLTXOYQMV-UHFFFAOYSA-N

mass

  • 461.810

monoisotopicmass

  • 460.10873

smiles

  • C1=C(C=CC(=C1)C(C=2C=CC=CC2)N3CCN(CC3)CCOCC(O)=O)Cl.Cl.Cl

subset

  • 2_STAR

synonym EXACT

  • Cetirizine hydrochloride

synonym RELATED

  • Zyrtec (TN)

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:3562

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