U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C14H21NO5S
Molecular Weight 315.385
Optical Activity ( + )
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-tert-Butoxycarbonylamino-1-methanesulfonyloxy-2-phenylethane, (S)-

SMILES

CC(C)(C)OC(=O)N[C@H](COS(C)(=O)=O)C1=CC=CC=C1

InChI

InChIKey=QMCZMSKKAHWYBJ-GFCCVEGCSA-N
InChI=1S/C14H21NO5S/c1-14(2,3)20-13(16)15-12(10-19-21(4,17)18)11-8-6-5-7-9-11/h5-9,12H,10H2,1-4H3,(H,15,16)/t12-/m1/s1

HIDE SMILES / InChI

Molecular Formula C14H21NO5S
Molecular Weight 315.385
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 Sat Dec 16 19:30:10 GMT 2023
Edited
by admin
on Sat Dec 16 19:30:10 GMT 2023
Record UNII
YVA32AE7TW
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-tert-Butoxycarbonylamino-1-methanesulfonyloxy-2-phenylethane, (S)-
Systematic Name English
1,1-Dimethylethyl N-[(1S)-2-[(methylsulfonyl)oxy]-1-phenylethyl]carbamate
Systematic Name English
Carbamic acid, N-[(1S)-2-[(methylsulfonyl)oxy]-1-phenylethyl]-, 1,1-dimethylethyl ester
Systematic Name English
Carbamic acid, [2-[(methylsulfonyl)oxy]-1-phenylethyl]-, 1,1-dimethylethyl ester, (S)-
Systematic Name English
(S)-2-Phenyl-2-tert-butoxycarbonylaminoethyl methanesulfonate
Systematic Name English
Code System Code Type Description
PUBCHEM
10335849
Created by admin on Sat Dec 16 19:30:10 GMT 2023 , Edited by admin on Sat Dec 16 19:30:10 GMT 2023
PRIMARY
FDA UNII
YVA32AE7TW
Created by admin on Sat Dec 16 19:30:10 GMT 2023 , Edited by admin on Sat Dec 16 19:30:10 GMT 2023
PRIMARY
CAS
110143-62-9
Created by admin on Sat Dec 16 19:30:10 GMT 2023 , Edited by admin on Sat Dec 16 19:30:10 GMT 2023
PRIMARY