DES(TRIFLUOROACETYL)MK-0686

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C20H20ClFN2O3
Molecular Weight	390.836
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of DES(TRIFLUOROACETYL)MK-0686

Structure Search

SMILES

COC(=O)C1=C(C=CC=C1Cl)C2=CC(F)=C(C=C2)[C@@H](C)NC(=O)C3(N)CC3

InChI

InChIKey=HFWOMHQBJGXQFK-LLVKDONJSA-N

InChI=1S/C20H20ClFN2O3/c1-11(24-19(26)20(23)8-9-20)13-7-6-12(10-16(13)22)14-4-3-5-15(21)17(14)18(25)27-2/h3-7,10-11H,8-9,23H2,1-2H3,(H,24,26)/t11-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C20H20ClFN2O3
Molecular Weight	390.836
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 `Wed Apr 02 06:40:30 GMT 2025` Edited by `admin` on `Wed Apr 02 06:40:30 GMT 2025`
Record UNII	3CDF0U3XHI
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

MK-0686 METABOLITE M1

Preferred Name

English

DES(TRIFLUOROACETYL)MK-0686

Common Name

English

(1,1'-BIPHENYL)-2-CARBOXYLIC ACID, 4'-((1R)-1-(((1-AMINOCYCLOPROPYL)CARBONYL)AMINO)ETHYL)-3-CHLORO-3'-FLUORO-, METHYL ESTER

Systematic Name

English

Code System Code Type Description

FDA UNII

3CDF0U3XHI

Created by admin on Wed Apr 02 06:40:30 GMT 2025 , Edited by admin on Wed Apr 02 06:40:30 GMT 2025

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CAS

756473-92-4

Created by admin on Wed Apr 02 06:40:30 GMT 2025 , Edited by admin on Wed Apr 02 06:40:30 GMT 2025

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PUBCHEM

87953573

Created by admin on Wed Apr 02 06:40:30 GMT 2025 , Edited by admin on Wed Apr 02 06:40:30 GMT 2025

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