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Details

Stereochemistry MIXED
Molecular Formula C15H11ClF3NO2
Molecular Weight 329.702
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of METHYL EFAVIRENZ

SMILES

CC1CC1C#C[C@@]2(OC(=O)NC3=CC=C(Cl)C=C23)C(F)(F)F

InChI

InChIKey=VTRDGEWILKMMRP-CTCYHXBNSA-N
InChI=1S/C15H11ClF3NO2/c1-8-6-9(8)4-5-14(15(17,18)19)11-7-10(16)2-3-12(11)20-13(21)22-14/h2-3,7-9H,6H2,1H3,(H,20,21)/t8?,9?,14-/m0/s1

HIDE SMILES / InChI

Molecular Formula C15H11ClF3NO2
Molecular Weight 329.702
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry
Defined Stereocenters 1 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Tue Oct 22 18:45:42 UTC 2019
Edited
by admin
on Tue Oct 22 18:45:42 UTC 2019
Record UNII
GS9U39RG71
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
METHYL EFAVIRENZ
USP  
Common Name English
2H-3,1-BENZOXAZIN-2-ONE, 6-CHLORO-1,4-DIHYDRO-4-((2-METHYLCYCLOPROPYL)ETHYNYL)-4-(TRIFLUOROMETHYL)-, (4S)-
Systematic Name English
METHYL-DMP 266
Common Name English
(S)-6-CHLORO-4-(((2RS,2RS)-2-METHYLCYCLOPROPYL)ETHYNYL(-4-(TRIFLUOROMETHYL)-2H-3,1-BENZOXAZIN-2-ONE
Common Name English
METHYL EFAVIRENZ [USP]
Common Name English
EFAVIRENZ IMPURITY G [WHO-IP]
Common Name English
EFAVIRENZ IMPURITY, METHYL EFAVIRENZ-
Common Name English
2H-3,1-BENZOXAZIN-2-ONE, 6-CHLORO-1,4-DIHYDRO-4-(2-(2-METHYLCYCLOPROPYL)ETHYNYL)-4-(TRIFLUOROMETHYL)-, (4S)-
Systematic Name English
SV-997
Code English
Code System Code Type Description
CAS
353270-76-5
Created by admin on Tue Oct 22 18:45:42 UTC 2019 , Edited by admin on Tue Oct 22 18:45:42 UTC 2019
PRIMARY
PUBCHEM
71587715
Created by admin on Tue Oct 22 18:45:42 UTC 2019 , Edited by admin on Tue Oct 22 18:45:42 UTC 2019
PRIMARY
Related Record Type Details
PARENT -> IMPURITY