tert-Butyl ((5S,6R)-6-methyl-2-oxo-5-(2,3,6-trifluorophenyl)piperidin-3-yl)carbamate

Details

Stereochemistry	EPIMERIC
Molecular Formula	C17H21F3N2O3
Molecular Weight	358.3554
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of tert-Butyl ((5S,6R)-6-methyl-2-oxo-5-(2,3,6-trifluorophenyl)piperidin-3-yl)carbamate

Structure Search

SMILES

C[C@H]1NC(=O)C(C[C@H]1C2=C(F)C(F)=CC=C2F)NC(=O)OC(C)(C)C

InChI

InChIKey=CARIKAXEUGTSFR-LSLJNABFSA-N

InChI=1S/C17H21F3N2O3/c1-8-9(13-10(18)5-6-11(19)14(13)20)7-12(15(23)21-8)22-16(24)25-17(2,3)4/h5-6,8-9,12H,7H2,1-4H3,(H,21,23)(H,22,24)/t8-,9-,12?/m1/s1

HIDE SMILES / InChI

Molecular Formula	C17H21F3N2O3
Molecular Weight	358.3554
Charge	0
Count

Stereochemistry	EPIMERIC
Additional Stereochemistry	No
Defined Stereocenters	2 / 3
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 19:16:29 GMT 2025` Edited by `admin` on `Wed Apr 02 19:16:29 GMT 2025`
Record UNII	XJ4WAY47TS
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1,1-Dimethylethyl N-[(5S,6R)-6-methyl-2-oxo-5-(2,3,6-trifluorophenyl)-3-piperidinyl]carbamate

Preferred Name

English

tert-Butyl ((5S,6R)-6-methyl-2-oxo-5-(2,3,6-trifluorophenyl)piperidin-3-yl)carbamate

Systematic Name

English

Carbamic acid, N-[(5S,6R)-6-methyl-2-oxo-5-(2,3,6-trifluorophenyl)-3-piperidinyl]-, 1,1-dimethylethyl ester

Systematic Name

English

Code System Code Type Description

PUBCHEM

89821820

Created by admin on Wed Apr 02 19:16:29 GMT 2025 , Edited by admin on Wed Apr 02 19:16:29 GMT 2025

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CAS

1456803-42-1

Created by admin on Wed Apr 02 19:16:29 GMT 2025 , Edited by admin on Wed Apr 02 19:16:29 GMT 2025

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FDA UNII

XJ4WAY47TS

Created by admin on Wed Apr 02 19:16:29 GMT 2025 , Edited by admin on Wed Apr 02 19:16:29 GMT 2025

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