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Details

Stereochemistry RACEMIC
Molecular Formula C19H18Cl2N2O4
Molecular Weight 409.263
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-(2,3-Dichloro-phenyl)-2,6-dimethyl-1,4-dihydro-pyridine-3,5-dicarboxylic acid 3-(2-cyano-ethyl) ester 5-methyl ester

SMILES

COC(=O)C1=C(C)NC(C)=C(C1C2=CC=CC(Cl)=C2Cl)C(=O)OCCC#N

InChI

InChIKey=IVCOGJGSSDCCEZ-UHFFFAOYSA-N
InChI=1S/C19H18Cl2N2O4/c1-10-14(18(24)26-3)16(12-6-4-7-13(20)17(12)21)15(11(2)23-10)19(25)27-9-5-8-22/h4,6-7,16,23H,5,9H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C19H18Cl2N2O4
Molecular Weight 409.263
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 17:11:07 GMT 2025
Edited
by admin
on Wed Apr 02 17:11:07 GMT 2025
Record UNII
77AD3HZ6QG
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-(2,3-Dichloro-phenyl)-2,6-dimethyl-1,4-dihydro-pyridine-3,5-dicarboxylic acid 3-(2-cyano-ethyl) ester 5-methyl ester
Systematic Name English
3,5-Pyridinedicarboxylic acid, 4-(2,3-dichlorophenyl)-1,4-dihydro-2,6-dimethyl-, 2-cyanoethyl methyl ester
Preferred Name English
5-O-(2-cyanoethyl) 3-O-methyl 4-(2,3-dichlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
Systematic Name English
3-(2-Cyanoethyl) 5-methyl 4-(2,3-dichlorophenyl)-1,4-dihydro-2,6-dimethyl-3,5-pyridinedicarboxylate
Systematic Name English
3,5-Pyridinedicarboxylic acid, 4-(2,3-dichlorophenyl)-1,4-dihydro-2,6-dimethyl-, 3-(2-cyanoethyl) 5-methyl ester (
Systematic Name English
Code System Code Type Description
FDA UNII
77AD3HZ6QG
Created by admin on Wed Apr 02 17:11:07 GMT 2025 , Edited by admin on Wed Apr 02 17:11:07 GMT 2025
PRIMARY
CAS
110962-94-2
Created by admin on Wed Apr 02 17:11:07 GMT 2025 , Edited by admin on Wed Apr 02 17:11:07 GMT 2025
PRIMARY
PUBCHEM
9978851
Created by admin on Wed Apr 02 17:11:07 GMT 2025 , Edited by admin on Wed Apr 02 17:11:07 GMT 2025
PRIMARY