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Details

Stereochemistry ACHIRAL
Molecular Formula C18H8BrN3O
Molecular Weight 362.18
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-Bromoascididemin

SMILES

BrC1=CC2=C(C=C1)C3=CC=NC4=C3C(=N2)C(=O)C5=CC=CN=C45

InChI

InChIKey=CPXBDTZAJSRIKJ-UHFFFAOYSA-N
InChI=1S/C18H8BrN3O/c19-9-3-4-10-11-5-7-21-16-14(11)17(22-13(10)8-9)18(23)12-2-1-6-20-15(12)16/h1-8H

HIDE SMILES / InChI

Molecular Formula C18H8BrN3O
Molecular Weight 362.18
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 Tue Apr 01 19:42:16 GMT 2025
Edited
by admin
on Tue Apr 01 19:42:16 GMT 2025
Record UNII
NER7TL6RJT
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-659779
Preferred Name English
2-Bromoascididemin
Common Name English
5-bromo-2,12,15-triazapentacyclo[11.7.1.03,8.09,21.014,19]henicosa-1(21),2,4,6,8,10,12,14(19),15,17-decaen-20-one
Systematic Name English
2-Bromoleptoclinidinone
Common Name English
9H-Quino[4,3,2-de][1,10]phenanthrolin-9-one, 6-bromo-
Systematic Name English
6-Bromo-9H-quino[4,3,2-de][1,10]phenanthrolin-9-one
Systematic Name English
Code System Code Type Description
NSC
659779
Created by admin on Tue Apr 01 19:42:16 GMT 2025 , Edited by admin on Tue Apr 01 19:42:16 GMT 2025
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EPA CompTox
DTXSID20911366
Created by admin on Tue Apr 01 19:42:16 GMT 2025 , Edited by admin on Tue Apr 01 19:42:16 GMT 2025
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CAS
109802-17-7
Created by admin on Tue Apr 01 19:42:16 GMT 2025 , Edited by admin on Tue Apr 01 19:42:16 GMT 2025
PRIMARY
PUBCHEM
378074
Created by admin on Tue Apr 01 19:42:16 GMT 2025 , Edited by admin on Tue Apr 01 19:42:16 GMT 2025
PRIMARY
FDA UNII
NER7TL6RJT
Created by admin on Tue Apr 01 19:42:16 GMT 2025 , Edited by admin on Tue Apr 01 19:42:16 GMT 2025
PRIMARY