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CHEBI:83851 - 1-(biphenyl-4-yloxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-ol

ChEBI IDCHEBI:83851
ChEBI Name1-(biphenyl-4-yloxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-ol
Stars
DefinitionA member of the class of triazoles that is 3,3-dimethyl-1-(1,2,4-triazol-1-yl)butane-1,2-diol substituted at position O-1 by a biphenyl-4-yl group.
Last Modified21 November 2014
SubmitterSteve
DownloadsMolfile
FormulaC20H23N3O2
Net Charge0
Average Mass337.423
Monoisotopic Mass337.17903
SMILESCC(C)(C)C(O)C(Oc1ccc(-c2ccccc2)cc1)n1cncn1
InChIInChI=1S/C20H23N3O2/c1-20(2,3)18(24)19(23-14-21-13-22-23)25-17-11-9-16(10-12-17)15-7-5-4-6-8-15/h4-14,18-19,24H,1-3H3
InChIKeyVGPIBGGRCVEHQZ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
1-(biphenyl-4-yloxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-ol (CHEBI:83851) is a aromatic ether (CHEBI:35618)
1-(biphenyl-4-yloxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-ol (CHEBI:83851) is a biphenyls (CHEBI:22888)
1-(biphenyl-4-yloxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-ol (CHEBI:83851) is a secondary alcohol (CHEBI:35681)
1-(biphenyl-4-yloxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-ol (CHEBI:83851) is a triazoles (CHEBI:35727)
Incoming Relation(s)
(1R,2R)-bitertanol (CHEBI:83854) is a 1-(biphenyl-4-yloxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-ol (CHEBI:83851)
(1R,2S)-bitertanol (CHEBI:83858) is a 1-(biphenyl-4-yloxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-ol (CHEBI:83851)
(1S,2R)-bitertanol (CHEBI:83857) is a 1-(biphenyl-4-yloxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-ol (CHEBI:83851)
(1S,2S)-bitertanol (CHEBI:83855) is a 1-(biphenyl-4-yloxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-ol (CHEBI:83851)
IUPAC Name 
1-(biphenyl-4-yloxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol
Manual XrefsDatabases
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