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Details

Stereochemistry ABSOLUTE
Molecular Formula C22H27NO6S
Molecular Weight 433.518
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Benzyl 2-((tert-butoxycarbonyl)amino)-3-(3-(methylsulfonyl)phenyl)propanoate, (S)-

SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=CC(=CC=C1)S(C)(=O)=O)C(=O)OCC2=CC=CC=C2

InChI

InChIKey=PHBQFYLTLBWTNF-IBGZPJMESA-N
InChI=1S/C22H27NO6S/c1-22(2,3)29-21(25)23-19(20(24)28-15-16-9-6-5-7-10-16)14-17-11-8-12-18(13-17)30(4,26)27/h5-13,19H,14-15H2,1-4H3,(H,23,25)/t19-/m0/s1

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
Benzyl 2-((tert-butoxycarbonyl)amino)-3-(3-(methylsulfonyl)phenyl)propanoate, (S)-
Systematic Name English
L-Phenylalanine, N-[(1,1-dimethylethoxy)carbonyl]-3-(methylsulfonyl)-, phenylmethyl ester
Systematic Name English
N-[(1,1-Dimethylethoxy)carbonyl]-3-(methylsulfonyl)-L-phenylalanine phenylmethyl ester
Systematic Name English
(S)-Benzyl 2-((tert-butoxycarbonyl)amino)-3-(3-(methylsulfonyl)phenyl)propanoate
Systematic Name English
Code System Code Type Description
PUBCHEM
57992282
Created by admin on Sat Dec 16 19:23:38 GMT 2023 , Edited by admin on Sat Dec 16 19:23:38 GMT 2023
PRIMARY
FDA UNII
LK25R79VGU
Created by admin on Sat Dec 16 19:23:38 GMT 2023 , Edited by admin on Sat Dec 16 19:23:38 GMT 2023
PRIMARY
CAS
1289646-78-1
Created by admin on Sat Dec 16 19:23:38 GMT 2023 , Edited by admin on Sat Dec 16 19:23:38 GMT 2023
PRIMARY
NIH
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