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Details

Stereochemistry RACEMIC
Molecular Formula C37H32ClN3O8
Molecular Weight 682.118
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Methyl 4-(2-chlorophenyl)-6-[[2-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)ethoxy]methyl]-5-[4-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)-1-oxobutyl]-1,4-dihydro-2-methyl-3-pyridinecarboxylate

SMILES

COC(=O)C1=C(C)NC(COCCN2C(=O)C3=CC=CC=C3C2=O)=C(C1C4=CC=CC=C4Cl)C(=O)CCCN5C(=O)C6=CC=CC=C6C5=O

InChI

InChIKey=NHVDPQDXBLKGPI-UHFFFAOYSA-N
InChI=1S/C37H32ClN3O8/c1-21-30(37(47)48-2)31(26-14-7-8-15-27(26)38)32(29(42)16-9-17-40-33(43)22-10-3-4-11-23(22)34(40)44)28(39-21)20-49-19-18-41-35(45)24-12-5-6-13-25(24)36(41)46/h3-8,10-15,31,39H,9,16-20H2,1-2H3

HIDE SMILES / InChI

Approval Year

Name Type Language
3-Pyridinecarboxylic acid, 4-(2-chlorophenyl)-6-[[2-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)ethoxy]methyl]-5-[4-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)-1-oxobutyl]-1,4-dihydro-2-methyl-, methyl ester
Preferred Name English
Methyl 4-(2-chlorophenyl)-6-[[2-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)ethoxy]methyl]-5-[4-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)-1-oxobutyl]-1,4-dihydro-2-methyl-3-pyridinecarboxylate
Systematic Name English
Code System Code Type Description
CAS
223734-98-3
Created by admin on Wed Apr 02 17:10:10 GMT 2025 , Edited by admin on Wed Apr 02 17:10:10 GMT 2025
PRIMARY
PUBCHEM
165366063
Created by admin on Wed Apr 02 17:10:10 GMT 2025 , Edited by admin on Wed Apr 02 17:10:10 GMT 2025
PRIMARY
FDA UNII
X3MXL93GB7
Created by admin on Wed Apr 02 17:10:10 GMT 2025 , Edited by admin on Wed Apr 02 17:10:10 GMT 2025
PRIMARY
EPA CompTox
DTXSID501098631
Created by admin on Wed Apr 02 17:10:10 GMT 2025 , Edited by admin on Wed Apr 02 17:10:10 GMT 2025
PRIMARY