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Concept information

Preferred term

n-[(2r,3r,6s)-6-[2-[[(4-chloroanilino)-oxomethyl]amino]ethyl]-2-(hydroxymethyl)-3-oxanyl]cyclohexanecarboxamide  

Type

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

Broader concept

charge

  • 0

formula

  • C22H32ClN3O4

inchi

  • InChI=1S/C22H32ClN3O4/c23-16-6-8-17(9-7-16)25-22(29)24-13-12-18-10-11-19(20(14-27)30-18)26-21(28)15-4-2-1-3-5-15/h6-9,15,18-20,27H,1-5,10-14H2,(H,26,28)(H2,24,25,29)/t18-,19+,20-/m0/s1

inchikey

  • CMUIIZXJLAYAHO-ZCNNSNEGSA-N

mass

  • 437.961

monoisotopicmass

  • 437.20813

smiles

  • C1CCC(CC1)C(=O)N[C@@H]2CC[C@H](O[C@H]2CO)CCNC(=O)NC3=CC=C(C=C3)Cl

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:117908

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