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Details

Stereochemistry ACHIRAL
Molecular Formula C17H14F3NO4
Molecular Weight 353.2926
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-METHOXY-3-((((4-(TRIFLUOROMETHYL)PHENYL)METHYL)AMINO)CARBONYL)BENZOIC ACID

SMILES

COC1=C(C=C(C=C1)C(O)=O)C(=O)NCC2=CC=C(C=C2)C(F)(F)F

InChI

InChIKey=SHAYUHMSKQKLFZ-UHFFFAOYSA-N
InChI=1S/C17H14F3NO4/c1-25-14-7-4-11(16(23)24)8-13(14)15(22)21-9-10-2-5-12(6-3-10)17(18,19)20/h2-8H,9H2,1H3,(H,21,22)(H,23,24)

HIDE SMILES / InChI

Molecular Formula C17H14F3NO4
Molecular Weight 353.2926
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 08:08:54 GMT 2025
Edited
by admin
on Wed Apr 02 08:08:54 GMT 2025
Record UNII
WY74VSE2QY
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
MK 767 METABOLITE M11
Preferred Name English
4-METHOXY-3-((((4-(TRIFLUOROMETHYL)PHENYL)METHYL)AMINO)CARBONYL)BENZOIC ACID
Systematic Name English
BENZOIC ACID, 4-METHOXY-3-((((4-(TRIFLUOROMETHYL)PHENYL)METHYL)AMINO)CARBONYL)-
Systematic Name English
Code System Code Type Description
PUBCHEM
9798618
Created by admin on Wed Apr 02 08:08:54 GMT 2025 , Edited by admin on Wed Apr 02 08:08:54 GMT 2025
PRIMARY
CAS
330861-58-0
Created by admin on Wed Apr 02 08:08:54 GMT 2025 , Edited by admin on Wed Apr 02 08:08:54 GMT 2025
PRIMARY
FDA UNII
WY74VSE2QY
Created by admin on Wed Apr 02 08:08:54 GMT 2025 , Edited by admin on Wed Apr 02 08:08:54 GMT 2025
PRIMARY
Related Record Type Details
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URINE