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Details

Stereochemistry RACEMIC
Molecular Formula C24H22NO4.Cl
Molecular Weight 423.889
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-Benzyl-4-(5,6-dimethoxy-1-oxo-indane-2-carbonyl)-pyridinium chloride

SMILES

[Cl-].COC1=C(OC)C=C2C(=O)C(CC2=C1)C(=O)C3=CC=[N+](CC4=CC=CC=C4)C=C3

InChI

InChIKey=ZQKYQNZQKAWSJJ-UHFFFAOYSA-M
InChI=1S/C24H22NO4.ClH/c1-28-21-13-18-12-20(24(27)19(18)14-22(21)29-2)23(26)17-8-10-25(11-9-17)15-16-6-4-3-5-7-16;/h3-11,13-14,20H,12,15H2,1-2H3;1H/q+1;/p-1

HIDE SMILES / InChI

Approval Year

Name Type Language
4-[(2,3-Dihydro-5,6-dimethoxy-1-oxo-1H-inden-2-yl)carbonyl]-1-(phenylmethyl)pyridinium chloride
Preferred Name English
1-Benzyl-4-(5,6-dimethoxy-1-oxo-indane-2-carbonyl)-pyridinium chloride
Systematic Name English
Pyridinium, 4-[(2,3-dihydro-5,6-dimethoxy-1-oxo-1H-inden-2-yl)carbonyl]-1-(phenylmethyl)-, chloride (1:1)
Systematic Name English
Code System Code Type Description
PUBCHEM
68998334
Created by admin on Wed Apr 02 17:41:37 GMT 2025 , Edited by admin on Wed Apr 02 17:41:37 GMT 2025
PRIMARY
CAS
923571-16-8
Created by admin on Wed Apr 02 17:41:37 GMT 2025 , Edited by admin on Wed Apr 02 17:41:37 GMT 2025
PRIMARY
FDA UNII
G4G4WPY6JC
Created by admin on Wed Apr 02 17:41:37 GMT 2025 , Edited by admin on Wed Apr 02 17:41:37 GMT 2025
PRIMARY