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Details

Stereochemistry ABSOLUTE
Molecular Formula C17H20NO3.K
Molecular Weight 325.4439
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ETODOLAC POTASSIUM, (S)-

SMILES

[K+].CCC1=CC=CC2=C1NC3=C2CCO[C@@]3(CC)CC([O-])=O

InChI

InChIKey=VUVPSKOUJUOWDC-LMOVPXPDSA-M
InChI=1S/C17H21NO3.K/c1-3-11-6-5-7-12-13-8-9-21-17(4-2,10-14(19)20)16(13)18-15(11)12;/h5-7,18H,3-4,8-10H2,1-2H3,(H,19,20);/q;+1/p-1/t17-;/m0./s1

HIDE SMILES / InChI

Molecular Formula C17H20NO3
Molecular Weight 286.3456
Charge -1
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula K
Molecular Weight 39.0983
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 01:54:22 UTC 2023
Edited
by admin
on Sat Dec 16 01:54:22 UTC 2023
Record UNII
C6SXT5145F
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ETODOLAC POTASSIUM, (S)-
Common Name English
PYRANO(3,4-B)INDOLE-1-ACETIC ACID, 1,8-DIETHYL-1,3,4,9-TETRAHYDRO-, MONOPOTASSIUM SALT, (S)-
Systematic Name English
Code System Code Type Description
CAS
170222-32-9
Created by admin on Sat Dec 16 01:54:22 UTC 2023 , Edited by admin on Sat Dec 16 01:54:22 UTC 2023
PRIMARY
FDA UNII
C6SXT5145F
Created by admin on Sat Dec 16 01:54:22 UTC 2023 , Edited by admin on Sat Dec 16 01:54:22 UTC 2023
PRIMARY
PUBCHEM
124220557
Created by admin on Sat Dec 16 01:54:22 UTC 2023 , Edited by admin on Sat Dec 16 01:54:22 UTC 2023
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER