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Details

Stereochemistry RACEMIC
Molecular Formula C15H20INO4
Molecular Weight 405.2281
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (±)-(R/S)-2-TERT-BUTOXYCARBONYLAMINO-3-(4-IODO-PHENYL)-PROPIONIC ACID METHYL ESTER

SMILES

COC(=O)C(CC1=CC=C(I)C=C1)NC(=O)OC(C)(C)C

InChI

InChIKey=HNCUXLSIVYDGBW-UHFFFAOYSA-N
InChI=1S/C15H20INO4/c1-15(2,3)21-14(19)17-12(13(18)20-4)9-10-5-7-11(16)8-6-10/h5-8,12H,9H2,1-4H3,(H,17,19)

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
D,L-PHENYLALANINE, N-((1,1-DIMETHYLETHOXY)CARBONYL)-4-IODO-, METHYL ESTER
Preferred Name English
(±)-(R/S)-2-TERT-BUTOXYCARBONYLAMINO-3-(4-IODO-PHENYL)-PROPIONIC ACID METHYL ESTER
Systematic Name English
Code System Code Type Description
CAS
796072-33-8
Created by admin on Wed Apr 02 05:24:44 GMT 2025 , Edited by admin on Wed Apr 02 05:24:44 GMT 2025
PRIMARY
FDA UNII
T2G0WI9NEZ
Created by admin on Wed Apr 02 05:24:44 GMT 2025 , Edited by admin on Wed Apr 02 05:24:44 GMT 2025
PRIMARY
PUBCHEM
13875796
Created by admin on Wed Apr 02 05:24:44 GMT 2025 , Edited by admin on Wed Apr 02 05:24:44 GMT 2025
PRIMARY
NIH
NCATS
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