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Details

Stereochemistry ACHIRAL
Molecular Formula C15H9Cl3N2O
Molecular Weight 339.604
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6-Chloro-2-(chloromethyl)-4-(2-chlorophenyl)-3-oxidoquinazolin-3-ium

SMILES

[O-][N+]1=C(C2=CC(Cl)=CC=C2N=C1CCl)C3=C(Cl)C=CC=C3

InChI

InChIKey=KIGAFJFQUZQHSD-UHFFFAOYSA-N
InChI=1S/C15H9Cl3N2O/c16-8-14-19-13-6-5-9(17)7-11(13)15(20(14)21)10-3-1-2-4-12(10)18/h1-7H,8H2

HIDE SMILES / InChI

Molecular Formula C15H9Cl3N2O
Molecular Weight 339.604
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 Wed Apr 02 20:33:28 GMT 2025
Edited
by admin
on Wed Apr 02 20:33:28 GMT 2025
Record UNII
BWA9A9E6SL
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-58778
Preferred Name English
6-Chloro-2-(chloromethyl)-4-(2-chlorophenyl)-3-oxidoquinazolin-3-ium
Systematic Name English
Quinazoline, 6-chloro-2-(chloromethyl)-4-(2-chlorophenyl)-, 3-oxide
Systematic Name English
Code System Code Type Description
CAS
13949-50-3
Created by admin on Wed Apr 02 20:33:28 GMT 2025 , Edited by admin on Wed Apr 02 20:33:28 GMT 2025
PRIMARY
FDA UNII
BWA9A9E6SL
Created by admin on Wed Apr 02 20:33:28 GMT 2025 , Edited by admin on Wed Apr 02 20:33:28 GMT 2025
PRIMARY
PUBCHEM
4983375
Created by admin on Wed Apr 02 20:33:28 GMT 2025 , Edited by admin on Wed Apr 02 20:33:28 GMT 2025
PRIMARY