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Details

Stereochemistry UNKNOWN
Molecular Formula C36H35F3N2O4
Molecular Weight 616.6693
Optical Activity ( + )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of S-15261, (+)-

SMILES

COC(CNCCOC(=O)C1=CC=C(CCNC(=O)CC2C3=C(C=CC=C3)C4=C2C=CC=C4)C=C1)C5=CC(=CC=C5)C(F)(F)F

InChI

InChIKey=ASWYZRRXMGAWGN-UHFFFAOYSA-N
InChI=1S/C36H35F3N2O4/c1-44-33(26-7-6-8-27(21-26)36(37,38)39)23-40-19-20-45-35(43)25-15-13-24(14-16-25)17-18-41-34(42)22-32-30-11-4-2-9-28(30)29-10-3-5-12-31(29)32/h2-16,21,32-33,40H,17-20,22-23H2,1H3,(H,41,42)

HIDE SMILES / InChI

Molecular Formula C36H35F3N2O4
Molecular Weight 616.6693
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Patents

Patents

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:01:45 GMT 2023
Edited
by admin
on Sat Dec 16 11:01:45 GMT 2023
Record UNII
34J8SAF62N
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
S-15261, (+)-
Code English
BENZOIC ACID, 4-(2-((2-(9H-FLUOREN-9-YL)ACETYL)AMINO)ETHYL)-, 2-((2-METHOXY-2-(3-(TRIFLUOROMETHYL)PHENYL)ETHYL)AMINO)ETHYL ESTER, (+)-
Systematic Name English
(+)-2-((2-METHOXY-2-(3-(TRIFLUOROMETHYL)PHENYL)ETHYL)AMINO)ETHYL 4-(2-((2-(9H-FLUOREN-9-YL)ACETYL)AMINO)ETHYL)BENZOATE
Systematic Name English
BENZOIC ACID, 4-(2-((9H-FLUOREN-9-YLACETYL)AMINO)ETHYL)-, 2-((2-METHOXY-2-(3-(TRIFLUOROMETHYL)PHENYL)ETHYL)AMINO)ETHYL ESTER, (+)-
Systematic Name English
Code System Code Type Description
CAS
212752-68-6
Created by admin on Sat Dec 16 11:01:45 GMT 2023 , Edited by admin on Sat Dec 16 11:01:45 GMT 2023
PRIMARY
FDA UNII
34J8SAF62N
Created by admin on Sat Dec 16 11:01:45 GMT 2023 , Edited by admin on Sat Dec 16 11:01:45 GMT 2023
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER