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Details

Stereochemistry RACEMIC
Molecular Formula C21H26N2O7
Molecular Weight 418.4403
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-(2-Methoxyethyl) 5-(1-methylethyl) 1,4-dihydro-2,6-dimethyl-4-(2-nitrophenyl)-3,5-pyridinedicarboxylate

SMILES

COCCOC(=O)C1=C(C)NC(C)=C(C1C2=CC=CC=C2[N+]([O-])=O)C(=O)OC(C)C

InChI

InChIKey=CXBWOMOGVHSUDS-UHFFFAOYSA-N
InChI=1S/C21H26N2O7/c1-12(2)30-21(25)18-14(4)22-13(3)17(20(24)29-11-10-28-5)19(18)15-8-6-7-9-16(15)23(26)27/h6-9,12,19,22H,10-11H2,1-5H3

HIDE SMILES / InChI

Molecular Formula C21H26N2O7
Molecular Weight 418.4403
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 20:52:30 GMT 2025
Edited
by admin
on Wed Apr 02 20:52:30 GMT 2025
Record UNII
M78YQR8LLU
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-(2-Methoxyethyl) 5-(1-methylethyl) 1,4-dihydro-2,6-dimethyl-4-(2-nitrophenyl)-3,5-pyridinedicarboxylate
Preferred Name English
Code System Code Type Description
FDA UNII
M78YQR8LLU
Created by admin on Wed Apr 02 20:52:30 GMT 2025 , Edited by admin on Wed Apr 02 20:52:30 GMT 2025
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CAS
1316606-40-2
Created by admin on Wed Apr 02 20:52:30 GMT 2025 , Edited by admin on Wed Apr 02 20:52:30 GMT 2025
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PUBCHEM
14459249
Created by admin on Wed Apr 02 20:52:30 GMT 2025 , Edited by admin on Wed Apr 02 20:52:30 GMT 2025
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