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Details

Stereochemistry ACHIRAL
Molecular Formula C13H13NO4
Molecular Weight 247.2466
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of OPC-3952

SMILES

OC(=O)CCCOC1=CC2=C(C=CC(=O)N2)C=C1

InChI

InChIKey=UQCUKMDADXRDSD-UHFFFAOYSA-N
InChI=1S/C13H13NO4/c15-12-6-4-9-3-5-10(8-11(9)14-12)18-7-1-2-13(16)17/h3-6,8H,1-2,7H2,(H,14,15)(H,16,17)

HIDE SMILES / InChI

Molecular Formula C13H13NO4
Molecular Weight 247.2466
Charge 0
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 Tue Apr 01 16:22:22 GMT 2025
Edited
by admin
on Tue Apr 01 16:22:22 GMT 2025
Record UNII
16D0X6IIWJ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
OPC-3952
Common Name English
BUTANOIC ACID, 4-((1,2-DIHYDRO-2-OXO-7-QUINOLINYL)OXY)-
Preferred Name English
4-((1,2-DIHYDRO-2-OXO-7-QUINOLINYL)OXY)BUTANOIC ACID
Systematic Name English
Code System Code Type Description
CAS
62969-59-9
Created by admin on Tue Apr 01 16:22:22 GMT 2025 , Edited by admin on Tue Apr 01 16:22:22 GMT 2025
PRIMARY
PUBCHEM
13112614
Created by admin on Tue Apr 01 16:22:22 GMT 2025 , Edited by admin on Tue Apr 01 16:22:22 GMT 2025
PRIMARY
FDA UNII
16D0X6IIWJ
Created by admin on Tue Apr 01 16:22:22 GMT 2025 , Edited by admin on Tue Apr 01 16:22:22 GMT 2025
PRIMARY
Related Record Type Details
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URINE
PARENT -> METABOLITE