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Details

Stereochemistry ABSOLUTE
Molecular Formula C14H9ClF3NO4
Molecular Weight 347.674
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 8,14-DIHYDROXYEFAVIRENZ

SMILES

OC1=CC(Cl)=CC2=C1NC(=O)O[C@]2(C#CC3(O)CC3)C(F)(F)F

InChI

InChIKey=WILFXLMJFSKQRP-ZDUSSCGKSA-N
InChI=1S/C14H9ClF3NO4/c15-7-5-8-10(9(20)6-7)19-11(21)23-13(8,14(16,17)18)4-3-12(22)1-2-12/h5-6,20,22H,1-2H2,(H,19,21)/t13-/m0/s1

HIDE SMILES / InChI

Molecular Formula C14H9ClF3NO4
Molecular Weight 347.674
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 09:29:38 UTC 2023
Edited
by admin
on Sat Dec 16 09:29:38 UTC 2023
Record UNII
CUY87N1BWE
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
8,14-DIHYDROXYEFAVIRENZ
Common Name English
2H-3,1-BENZOXAZIN-2-ONE, 6-CHLORO-1,4-DIHYDRO-8-HYDROXY-4-((1-HYDROXYCYCLOPROPYL)ETHYNYL)-4-(TRIFLUOROMETHYL)-, (4S)-
Systematic Name English
(4S)-6-CHLORO-8-HYDROXY-4-(2-(1-HYDROXYCYCLOPROPYL)ETHYNYL)-4-(TRIFLUOROMETHYL)-1H-3,1-BENZOXAZIN-2-ONE
Systematic Name English
Code System Code Type Description
FDA UNII
CUY87N1BWE
Created by admin on Sat Dec 16 09:29:38 UTC 2023 , Edited by admin on Sat Dec 16 09:29:38 UTC 2023
PRIMARY
PUBCHEM
16725849
Created by admin on Sat Dec 16 09:29:38 UTC 2023 , Edited by admin on Sat Dec 16 09:29:38 UTC 2023
PRIMARY
CAS
252343-27-4
Created by admin on Sat Dec 16 09:29:38 UTC 2023 , Edited by admin on Sat Dec 16 09:29:38 UTC 2023
PRIMARY