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Details

Stereochemistry RACEMIC
Molecular Formula C13H19NO4
Molecular Weight 253.2943
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-(2-(tert-butylamino)-1-hydroxyethyl)-2-hydroxybenzoic acid

SMILES

CC(C)(C)NCC(O)C1=CC(C(O)=O)=C(O)C=C1

InChI

InChIKey=KHMZXXLVFHYJFH-UHFFFAOYSA-N
InChI=1S/C13H19NO4/c1-13(2,3)14-7-11(16)8-4-5-10(15)9(6-8)12(17)18/h4-6,11,14-16H,7H2,1-3H3,(H,17,18)

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
5-(2-(tert-butylamino)-1-hydroxyethyl)-2-hydroxybenzoic acid
Systematic Name English
5-[2-[(1,1-Dimethylethyl)amino]-1-hydroxyethyl]-2-hydroxybenzoic acid
Systematic Name English
5-(2-(tert-Butylamino)-1-hydroxyethyl)salicylic acid
Systematic Name English
Benzoic acid, 5-[2-[(1,1-dimethylethyl)amino]-1-hydroxyethyl]-2-hydroxy-
Systematic Name English
Code System Code Type Description
FDA UNII
53A8MWC93W
Created by admin on Fri Dec 15 16:12:30 GMT 2023 , Edited by admin on Fri Dec 15 16:12:30 GMT 2023
PRIMARY
PUBCHEM
22623314
Created by admin on Fri Dec 15 16:12:30 GMT 2023 , Edited by admin on Fri Dec 15 16:12:30 GMT 2023
PRIMARY
CAS
108956-88-3
Created by admin on Fri Dec 15 16:12:30 GMT 2023 , Edited by admin on Fri Dec 15 16:12:30 GMT 2023
PRIMARY
NIH
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