1,1-Dimethylethyl N-[(1R,2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-hydroxy-1-[[[(4-methylphenyl)sulfonyl]oxy]methyl]ethyl]carbamate

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C23H29NO8S
Molecular Weight	479.543
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 1,1-Dimethylethyl N-[(1R,2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-hydroxy-1-[[[(4-methylphenyl)sulfonyl]oxy]methyl]ethyl]carbamate

Structure Search

SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC[C@@H](NC(=O)OC(C)(C)C)[C@H](O)C2=CC=C3OCCOC3=C2

InChI

InChIKey=UKKZZUMYZWNHCN-WIYYLYMNSA-N

InChI=1S/C23H29NO8S/c1-15-5-8-17(9-6-15)33(27,28)31-14-18(24-22(26)32-23(2,3)4)21(25)16-7-10-19-20(13-16)30-12-11-29-19/h5-10,13,18,21,25H,11-12,14H2,1-4H3,(H,24,26)/t18-,21-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C23H29NO8S
Molecular Weight	479.543
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 17:09:39 GMT 2025` Edited by `admin` on `Wed Apr 02 17:09:39 GMT 2025`
Record UNII	N5Y8YD2RUW
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1,1-Dimethylethyl N-[(1R,2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-hydroxy-1-[[[(4-methylphenyl)sulfonyl]oxy]methyl]ethyl]carbamate

Systematic Name

English

Carbamic acid, N-[(1R,2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-hydroxy-1-[[[(4-methylphenyl)sulfonyl]oxy]methyl]ethyl]-, 1,1-dimethylethyl ester

Preferred Name

English

Code System Code Type Description

FDA UNII

N5Y8YD2RUW

Created by admin on Wed Apr 02 17:09:39 GMT 2025 , Edited by admin on Wed Apr 02 17:09:39 GMT 2025

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CAS

1972652-83-7

Created by admin on Wed Apr 02 17:09:39 GMT 2025 , Edited by admin on Wed Apr 02 17:09:39 GMT 2025

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PUBCHEM

171390024

Created by admin on Wed Apr 02 17:09:39 GMT 2025 , Edited by admin on Wed Apr 02 17:09:39 GMT 2025

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