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Details

Stereochemistry ACHIRAL
Molecular Formula C19H17ClN2O4
Molecular Weight 372.802
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-QUINOLINECARBOXAMIDE, 5-CHLORO-N-ETHYL-1,2-DIHYDRO-4-HYDROXY-N-(4-HYDROXYPHENYL)-1-METHYL-2-OXO-

SMILES

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

InChI

InChIKey=HBMNTNTZJMZXKP-UHFFFAOYSA-N
InChI=1S/C19H17ClN2O4/c1-3-22(11-7-9-12(23)10-8-11)19(26)16-17(24)15-13(20)5-4-6-14(15)21(2)18(16)25/h4-10,23-24H,3H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C19H17ClN2O4
Molecular Weight 372.802
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 16:16:35 GMT 2023
Edited
by admin
on Sat Dec 16 16:16:35 GMT 2023
Record UNII
JHU565H22V
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-QUINOLINECARBOXAMIDE, 5-CHLORO-N-ETHYL-1,2-DIHYDRO-4-HYDROXY-N-(4-HYDROXYPHENYL)-1-METHYL-2-OXO-
Systematic Name English
LAQUINIMOD METABOLITE M1
Common Name English
Code System Code Type Description
CAS
1348611-93-7
Created by admin on Sat Dec 16 16:16:35 GMT 2023 , Edited by admin on Sat Dec 16 16:16:35 GMT 2023
PRIMARY
FDA UNII
JHU565H22V
Created by admin on Sat Dec 16 16:16:35 GMT 2023 , Edited by admin on Sat Dec 16 16:16:35 GMT 2023
PRIMARY
PUBCHEM
154699630
Created by admin on Sat Dec 16 16:16:35 GMT 2023 , Edited by admin on Sat Dec 16 16:16:35 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE