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Concept information

Preferred term

(S) هیدرات هیدروکلراید هیدرات  

Type

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

Broader concept

charge

  • 0

formula

  • C17H29ClN2O2

inchi

  • InChI=1S/C17H26N2O.ClH.H2O/c1-4-11-19-12-6-5-10-15(19)17(20)18-16-13(2)8-7-9-14(16)3;;/h7-9,15H,4-6,10-12H2,1-3H3,(H,18,20);1H;1H2/t15-;;/m0../s1

inchikey

  • VSHFRHVKMYGBJL-CKUXDGONSA-N

mass

  • 328.87700

monoisotopicmass

  • 328.19176

smiles

  • O.[Cl-].CCC[NH+]1CCCC[C@H]1C(=O)Nc1c(C)cccc1C

subset

  • 3_STAR

synonym EXACT

  • (2S)-2-[(2,6-dimethylphenyl)carbamoyl]-1-propylpiperidinium chloride--water(1/1)
  • (2S)-N-(2,6-dimethylphenyl)-1-propylpiperidine-2-carboxamide hydrochloride--water (1/1)

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:34954

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