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Details

Stereochemistry ABSOLUTE
Molecular Formula C14H20O2
Molecular Weight 220.3074
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BUTIBUFEN, (S)-

SMILES

CC[C@H](C(O)=O)C1=CC=C(CC(C)C)C=C1

InChI

InChIKey=UULSXYSSHHRCQK-ZDUSSCGKSA-N
InChI=1S/C14H20O2/c1-4-13(14(15)16)12-7-5-11(6-8-12)9-10(2)3/h5-8,10,13H,4,9H2,1-3H3,(H,15,16)/t13-/m0/s1

HIDE SMILES / InChI

Molecular Formula C14H20O2
Molecular Weight 220.3074
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:27:33 GMT 2023
Edited
by admin
on Sat Dec 16 11:27:33 GMT 2023
Record UNII
P1BJ250VCY
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BUTIBUFEN, (S)-
Common Name English
BENZENEACETIC ACID, .ALPHA.-ETHYL-4-(2-METHYLPROPYL)-, (.ALPHA.S)-
Systematic Name English
(+)-BUTIBUFEN
Common Name English
Code System Code Type Description
FDA UNII
P1BJ250VCY
Created by admin on Sat Dec 16 11:27:33 GMT 2023 , Edited by admin on Sat Dec 16 11:27:33 GMT 2023
PRIMARY
CAS
149646-92-4
Created by admin on Sat Dec 16 11:27:33 GMT 2023 , Edited by admin on Sat Dec 16 11:27:33 GMT 2023
PRIMARY
PUBCHEM
70061383
Created by admin on Sat Dec 16 11:27:33 GMT 2023 , Edited by admin on Sat Dec 16 11:27:33 GMT 2023
PRIMARY
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