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Details

Stereochemistry ACHIRAL
Molecular Formula C30H20N4O4
Molecular Weight 500.5042
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3,12-Diethoxybisbenzimidazo[2,1-b:1?,2?-j]benzo[lmn][3,8]phenanthroline-6,9-dione

SMILES

CCOc1ccc2nc3c4ccc5c6nc7cccc(OCC)c7n6c(=O)c8ccc(c4c58)c(=O)n3c2c1

InChI

InChIKey=QPBJLJJVELJVSW-UHFFFAOYSA-N
InChI=1S/C30H20N4O4/c1-3-37-15-8-13-20-22(14-15)33-27(31-20)16-9-10-17-25-19(12-11-18(24(16)25)29(33)35)30(36)34-26-21(32-28(17)34)6-5-7-23(26)38-4-2/h5-14H,3-4H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C30H22N4O4
Molecular Weight 502.5201
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 17:36:48 GMT 2025
Edited
by admin
on Tue Apr 01 17:36:48 GMT 2025
Record UNII
GX6LC7SUU3
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Bisbenzimidazo[2,1-b:1?,2?-j]benzo[lmn][3,8]phenanthroline-6,9-dione, 3,12-diethoxy-
Preferred Name English
3,12-Diethoxybisbenzimidazo[2,1-b:1?,2?-j]benzo[lmn][3,8]phenanthroline-6,9-dione
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
233-413-1
Created by admin on Tue Apr 01 17:36:48 GMT 2025 , Edited by admin on Tue Apr 01 17:36:48 GMT 2025
PRIMARY
CAS
958777-68-9
Created by admin on Tue Apr 01 17:36:48 GMT 2025 , Edited by admin on Tue Apr 01 17:36:48 GMT 2025
PRIMARY
PUBCHEM
82407
Created by admin on Tue Apr 01 17:36:48 GMT 2025 , Edited by admin on Tue Apr 01 17:36:48 GMT 2025
PRIMARY
EPA CompTox
DTXSID70143933
Created by admin on Tue Apr 01 17:36:48 GMT 2025 , Edited by admin on Tue Apr 01 17:36:48 GMT 2025
PRIMARY
FDA UNII
GX6LC7SUU3
Created by admin on Tue Apr 01 17:36:48 GMT 2025 , Edited by admin on Tue Apr 01 17:36:48 GMT 2025
PRIMARY