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Details

Stereochemistry ABSOLUTE
Molecular Formula C17H15BrN2
Molecular Weight 327.218
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BROLACONAZOLE, (R)-

SMILES

BrC1=CC=C(C=C1)[C@H](CN2C=CN=C2)C3=CC=CC=C3

InChI

InChIKey=MLHFXOOXBZMGSH-QGZVFWFLSA-N
InChI=1S/C17H15BrN2/c18-16-8-6-15(7-9-16)17(12-20-11-10-19-13-20)14-4-2-1-3-5-14/h1-11,13,17H,12H2/t17-/m1/s1

HIDE SMILES / InChI

Molecular Formula C17H15BrN2
Molecular Weight 327.218
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:27:04 GMT 2023
Edited
by admin
on Sat Dec 16 10:27:04 GMT 2023
Record UNII
85KW4HY33I
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BROLACONAZOLE, (R)-
Common Name English
1H-IMIDAZOLE, 1-(2-(4-BROMOPHENYL)-2-PHENYLETHYL)-, (R)-
Systematic Name English
Code System Code Type Description
PUBCHEM
76965700
Created by admin on Sat Dec 16 10:27:04 GMT 2023 , Edited by admin on Sat Dec 16 10:27:04 GMT 2023
PRIMARY
FDA UNII
85KW4HY33I
Created by admin on Sat Dec 16 10:27:04 GMT 2023 , Edited by admin on Sat Dec 16 10:27:04 GMT 2023
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER