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

Details

Stereochemistry ACHIRAL
Molecular Formula C17H26N2O3
Molecular Weight 306.3999
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DIBUSADOL

SMILES

CCN(CC)CCCCNC(=O)C1=CC=CC=C1OC(C)=O

InChI

InChIKey=OXCRVQDEVWYAJE-UHFFFAOYSA-N
InChI=1S/C17H26N2O3/c1-4-19(5-2)13-9-8-12-18-17(21)15-10-6-7-11-16(15)22-14(3)20/h6-7,10-11H,4-5,8-9,12-13H2,1-3H3,(H,18,21)

HIDE SMILES / InChI
Name Type Language
DIBUSADOL
INN  
INN  
Official Name English
dibusadol [INN]
Common Name English
N-(4-(DIETHYLAMINO)BUTYL)SALICYLAMIDE ACETATE (ESTER)
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C241
Created by admin on Sat Dec 16 17:05:27 GMT 2023 , Edited by admin on Sat Dec 16 17:05:27 GMT 2023
Code System Code Type Description
PUBCHEM
3038221
Created by admin on Sat Dec 16 17:05:27 GMT 2023 , Edited by admin on Sat Dec 16 17:05:27 GMT 2023
PRIMARY
SMS_ID
100000082891
Created by admin on Sat Dec 16 17:05:27 GMT 2023 , Edited by admin on Sat Dec 16 17:05:27 GMT 2023
PRIMARY
EPA CompTox
DTXSID60179089
Created by admin on Sat Dec 16 17:05:27 GMT 2023 , Edited by admin on Sat Dec 16 17:05:27 GMT 2023
PRIMARY
CAS
24353-45-5
Created by admin on Sat Dec 16 17:05:27 GMT 2023 , Edited by admin on Sat Dec 16 17:05:27 GMT 2023
PRIMARY
NCI_THESAURUS
C77354
Created by admin on Sat Dec 16 17:05:27 GMT 2023 , Edited by admin on Sat Dec 16 17:05:27 GMT 2023
PRIMARY
FDA UNII
O55N96CWOW
Created by admin on Sat Dec 16 17:05:27 GMT 2023 , Edited by admin on Sat Dec 16 17:05:27 GMT 2023
PRIMARY
ChEMBL
CHEMBL2106263
Created by admin on Sat Dec 16 17:05:27 GMT 2023 , Edited by admin on Sat Dec 16 17:05:27 GMT 2023
PRIMARY
EVMPD
SUB07080MIG
Created by admin on Sat Dec 16 17:05:27 GMT 2023 , Edited by admin on Sat Dec 16 17:05:27 GMT 2023
PRIMARY
INN
2816
Created by admin on Sat Dec 16 17:05:27 GMT 2023 , Edited by admin on Sat Dec 16 17:05:27 GMT 2023
PRIMARY