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Details

Stereochemistry ACHIRAL
Molecular Formula C18H15ClN2O3
Molecular Weight 342.776
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DESMETHYL-LAQUINIMOD

SMILES

CCN(C(=O)C1=C(O)C2=C(NC1=O)C=CC=C2Cl)C3=CC=CC=C3

InChI

InChIKey=PRSDPSUTNKQSOJ-UHFFFAOYSA-N
InChI=1S/C18H15ClN2O3/c1-2-21(11-7-4-3-5-8-11)18(24)15-16(22)14-12(19)9-6-10-13(14)20-17(15)23/h3-10H,2H2,1H3,(H2,20,22,23)

HIDE SMILES / InChI

Molecular Formula C18H15ClN2O3
Molecular Weight 342.776
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 Sat Dec 16 16:09:43 GMT 2023
Edited
by admin
on Sat Dec 16 16:09:43 GMT 2023
Record UNII
PQ6H5FR2R6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DESMETHYL-LAQUINIMOD
Common Name English
LAQUINIMOD METABOLITE M5
Common Name English
3-QUINOLINECARBOXAMIDE, 5-CHLORO-N-ETHYL-1,2-DIHYDRO-4-HYDROXY-2-OXO-N-PHENYL-
Systematic Name English
Code System Code Type Description
CAS
1349096-12-3
Created by admin on Sat Dec 16 16:09:43 GMT 2023 , Edited by admin on Sat Dec 16 16:09:43 GMT 2023
PRIMARY
PUBCHEM
129041023
Created by admin on Sat Dec 16 16:09:43 GMT 2023 , Edited by admin on Sat Dec 16 16:09:43 GMT 2023
PRIMARY
FDA UNII
PQ6H5FR2R6
Created by admin on Sat Dec 16 16:09:43 GMT 2023 , Edited by admin on Sat Dec 16 16:09:43 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE