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Details

Stereochemistry ABSOLUTE
Molecular Formula C14H27NO4.ClH
Molecular Weight 309.829
Optical Activity ( + )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,1-Dimethylethyl 6-(2-aminoethyl)-2,2-dimethyl-1,3-dioxane-4-acetate hydrochloride (1:1), (4R-cis)-

SMILES

Cl.CC(C)(C)OC(=O)C[C@H]1C[C@@H](CCN)OC(C)(C)O1

InChI

InChIKey=NNQCINYASBFAKG-NDXYWBNTSA-N
InChI=1S/C14H27NO4.ClH/c1-13(2,3)19-12(16)9-11-8-10(6-7-15)17-14(4,5)18-11;/h10-11H,6-9,15H2,1-5H3;1H/t10-,11-;/m1./s1

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
1,1-Dimethylethyl 6-(2-aminoethyl)-2,2-dimethyl-1,3-dioxane-4-acetate hydrochloride (1:1), (4R-cis)-
Systematic Name English
1,3-Dioxane-4-acetic acid, 6-(2-aminoethyl)-2,2-dimethyl-, 1,1-dimethylethyl ester, hydrochloride (1:1), (4R,6R)-
Preferred Name English
Code System Code Type Description
FDA UNII
7RRE3FS6RA
Created by admin on Wed Apr 02 18:08:30 GMT 2025 , Edited by admin on Wed Apr 02 18:08:30 GMT 2025
PRIMARY
CAS
931114-37-3
Created by admin on Wed Apr 02 18:08:30 GMT 2025 , Edited by admin on Wed Apr 02 18:08:30 GMT 2025
PRIMARY
NIH
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