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Details

Stereochemistry ACHIRAL
Molecular Formula C26H20ClN5O5
Molecular Weight 517.921
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-[[4-[[3-Chloro-4-(2-pyridinylmethoxy)phenyl]amino]-3-cyano-7-ethoxy-6-quinolinyl]amino]-2-oxoacetic acid

SMILES

CCOC1=CC2=C(C=C1NC(=O)C(O)=O)C(NC3=CC(Cl)=C(OCC4=CC=CC=N4)C=C3)=C(C=N2)C#N

InChI

InChIKey=LJBZJAUBLJREAU-UHFFFAOYSA-N
InChI=1S/C26H20ClN5O5/c1-2-36-23-11-20-18(10-21(23)32-25(33)26(34)35)24(15(12-28)13-30-20)31-16-6-7-22(19(27)9-16)37-14-17-5-3-4-8-29-17/h3-11,13H,2,14H2,1H3,(H,30,31)(H,32,33)(H,34,35)

HIDE SMILES / InChI

Molecular Formula C26H20ClN5O5
Molecular Weight 517.921
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 18:52:38 GMT 2023
Edited
by admin
on Sat Dec 16 18:52:38 GMT 2023
Record UNII
AY5ECQ7B2D
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-[[4-[[3-Chloro-4-(2-pyridinylmethoxy)phenyl]amino]-3-cyano-7-ethoxy-6-quinolinyl]amino]-2-oxoacetic acid
Common Name English
Acetic acid, 2-[[4-[[3-chloro-4-(2-pyridinylmethoxy)phenyl]amino]-3-cyano-7-ethoxy-6-quinolinyl]amino]-2-oxo-
Systematic Name English
Code System Code Type Description
PUBCHEM
25267646
Created by admin on Sat Dec 16 18:52:38 GMT 2023 , Edited by admin on Sat Dec 16 18:52:38 GMT 2023
PRIMARY
FDA UNII
AY5ECQ7B2D
Created by admin on Sat Dec 16 18:52:38 GMT 2023 , Edited by admin on Sat Dec 16 18:52:38 GMT 2023
PRIMARY
CAS
1144516-13-1
Created by admin on Sat Dec 16 18:52:38 GMT 2023 , Edited by admin on Sat Dec 16 18:52:38 GMT 2023
PRIMARY