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Details

Stereochemistry ABSOLUTE
Molecular Formula C15H20ClN3O
Molecular Weight 293.792
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-(4-chlorophenyl)-4,4-dimethyl-2-(1,2,4-triazol-1-yl)pentan-3-ol, (2S,3R)-

SMILES

CC(C)(C)[C@@H](O)[C@H](CC1=CC=C(Cl)C=C1)N2C=NC=N2

InChI

InChIKey=RMOGWMIKYWRTKW-KBPBESRZSA-N
InChI=1S/C15H20ClN3O/c1-15(2,3)14(20)13(19-10-17-9-18-19)8-11-4-6-12(16)7-5-11/h4-7,9-10,13-14,20H,8H2,1-3H3/t13-,14-/m0/s1

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
1-(4-chlorophenyl)-4,4-dimethyl-2-(1,2,4-triazol-1-yl)pentan-3-ol, (2S,3R)-
Systematic Name English
(2S,3R)-1-(4-chlorophenyl)-4,4-dimethyl-2-(1,2,4-triazol-1-yl)pentan-3-ol
Systematic Name English
Paclobutrazol Impurity 2
Systematic Name English
1H-1,2,4-Triazole-1-ethanol, β-[(4-chlorophenyl)methyl]-α-(1,1-dimethylethyl)-, [R-(R*,S*)]-
Systematic Name English
Code System Code Type Description
FDA UNII
H5M338M9S9
Created by admin on Sat Dec 16 19:56:46 GMT 2023 , Edited by admin on Sat Dec 16 19:56:46 GMT 2023
PRIMARY
CAS
66345-53-7
Created by admin on Sat Dec 16 19:56:46 GMT 2023 , Edited by admin on Sat Dec 16 19:56:46 GMT 2023
PRIMARY
PUBCHEM
6455310
Created by admin on Sat Dec 16 19:56:46 GMT 2023 , Edited by admin on Sat Dec 16 19:56:46 GMT 2023
PRIMARY
NIH
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