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CHEBI:83748 - 2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol

ChEBI IDCHEBI:83748
ChEBI Name2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol
Stars
ASCII Name2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol
DefinitionA tertiary alcohol that is butan-2-ol substituted by a 4-chlorophenyl group at position 2, a cyclopropyl group at position 3 and a 1H-1,2,4-triazol-1-yl group at position 1.
Last Modified14 November 2014
Submitternamrata
DownloadsMolfile
FormulaC15H18ClN3O
Net Charge0
Average Mass291.782
Monoisotopic Mass291.11384
SMILESCC(C1CC1)C(O)(Cn1cncn1)c1ccc(Cl)cc1
InChIInChI=1S/C15H18ClN3O/c1-11(12-2-3-12)15(20,8-19-10-17-9-18-19)13-4-6-14(16)7-5-13/h4-7,9-12,20H,2-3,8H2,1H3
InChIKeyUFNOUKDBUJZYDE-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol (CHEBI:83748) is a cyclopropanes (CHEBI:51454)
2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol (CHEBI:83748) is a monochlorobenzenes (CHEBI:83403)
2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol (CHEBI:83748) is a tertiary alcohol (CHEBI:26878)
2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol (CHEBI:83748) is a triazoles (CHEBI:35727)
Incoming Relation(s)
(2R,3R)-cyproconazole (CHEBI:83753) is a 2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol (CHEBI:83748)
(2R,3S)-cyproconazole (CHEBI:83749) is a 2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol (CHEBI:83748)
(2S,3R)-cyproconazole (CHEBI:83752) is a 2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol (CHEBI:83748)
(2S,3S)-cyproconazole (CHEBI:83750) is a 2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol (CHEBI:83748)
IUPAC Name 
2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol
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