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Concept information

... > chemical entity > molecular entity > ion > cation > polyatomic cation > ammonium ion derivative > 1-[2-(benzhydryloxy)ethyl]-4-(3-phenylpropyl)piperazinediium(2+)
... > chemical entity > molecular entity > ion > polyatomic ion > polyatomic cation > ammonium ion derivative > 1-[2-(benzhydryloxy)ethyl]-4-(3-phenylpropyl)piperazinediium(2+)
... > chemical entity > molecular entity > polyatomic entity > polyatomic ion > polyatomic cation > ammonium ion derivative > 1-[2-(benzhydryloxy)ethyl]-4-(3-phenylpropyl)piperazinediium(2+)
... > chemical entity > molecular entity > ion > cation > organic cation > 1-[2-(benzhydryloxy)ethyl]-4-(3-phenylpropyl)piperazinediium(2+)
... > chemical entity > molecular entity > ion > organic ion > organic cation > 1-[2-(benzhydryloxy)ethyl]-4-(3-phenylpropyl)piperazinediium(2+)

Preferred term

1-[2-(benzhydryloxy)ethyl]-4-(3-phenylpropyl)piperazinediium(2+)  

Type

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

charge

  • +2

formula

  • C28H36N2O

inchi

  • InChI=1S/C28H34N2O/c1-4-11-25(12-5-1)13-10-18-29-19-21-30(22-20-29)23-24-31-28(26-14-6-2-7-15-26)27-16-8-3-9-17-27/h1-9,11-12,14-17,28H,10,13,18-24H2/p+2

inchikey

  • RAQPOZGWANIDQT-UHFFFAOYSA-P

mass

  • 416.59820

monoisotopicmass

  • 416.28167

smiles

  • C(C[NH+]1CC[NH+](CCOC(c2ccccc2)c2ccccc2)CC1)Cc1ccccc1

subset

  • 3_STAR

synonym EXACT

  • 1-[2-(diphenylmethoxy)ethyl]-4-(3-phenylpropyl)piperazinediium

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:64092

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