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Details

Stereochemistry RACEMIC
Molecular Formula C18H23NO3
Molecular Weight 301.3801
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ETODOLAC METHYL ESTER

SMILES

CCC1=CC=CC2=C1NC3=C2CCOC3(CC)CC(=O)OC

InChI

InChIKey=CRRWJZHQYUTACF-UHFFFAOYSA-N
InChI=1S/C18H23NO3/c1-4-12-7-6-8-13-14-9-10-22-18(5-2,11-15(20)21-3)17(14)19-16(12)13/h6-8,19H,4-5,9-11H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C18H23NO3
Molecular Weight 301.3801
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Thu Jul 06 22:49:36 UTC 2023
Edited
by admin
on Thu Jul 06 22:49:36 UTC 2023
Record UNII
9ZJE4H85SV
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ETODOLAC METHYL ESTER
Common Name English
PYRANO(3,4-B)INDOLE-1-ACETIC ACID, 1,8-DIETHYL-1,3,4,9-TETRAHYDRO-, METHYL ESTER
Systematic Name English
ETODOLAC IMPURITY K [EP IMPURITY]
Common Name English
METHYL 2-(1,8-DIETHYL-1,3,4,9-TETRAHYDROPYRANO(3,4-B)INDOL-1-YL)ACETATE
Systematic Name English
METHYL ((1RS)-1,8-DIETHYL-1,3,4,9-TETRAHYDROPYRANO(3,4-B)INDOL-1-YL)ACETATE
Systematic Name English
Code System Code Type Description
CAS
122188-02-7
Created by admin on Thu Jul 06 22:49:36 UTC 2023 , Edited by admin on Thu Jul 06 22:49:36 UTC 2023
PRIMARY
FDA UNII
9ZJE4H85SV
Created by admin on Thu Jul 06 22:49:36 UTC 2023 , Edited by admin on Thu Jul 06 22:49:36 UTC 2023
PRIMARY
EPA CompTox
DTXSID60881392
Created by admin on Thu Jul 06 22:49:36 UTC 2023 , Edited by admin on Thu Jul 06 22:49:36 UTC 2023
PRIMARY
PUBCHEM
527310
Created by admin on Thu Jul 06 22:49:36 UTC 2023 , Edited by admin on Thu Jul 06 22:49:36 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY