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Details

Stereochemistry ACHIRAL
Molecular Formula C20H14BrNO4
Molecular Weight 412.233
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6-Bromo-1-(ethoxycarbonyl)-3-methyl-7H-dibenz(f,ij)isoquinoline-2,7(3H)-dione

SMILES

CCOC(=O)C1=C2C3=CC=CC=C3C(=O)C4=C(Br)C=CC(N(C)C1=O)=C24

InChI

InChIKey=QMEYRRLFSLHNJG-UHFFFAOYSA-N
InChI=1S/C20H14BrNO4/c1-3-26-20(25)17-14-10-6-4-5-7-11(10)18(23)15-12(21)8-9-13(16(14)15)22(2)19(17)24/h4-9H,3H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C20H14BrNO4
Molecular Weight 412.233
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 20:12:33 GMT 2025
Edited
by admin
on Tue Apr 01 20:12:33 GMT 2025
Record UNII
7WA6WHH8WH
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-227204
Preferred Name English
6-Bromo-1-(ethoxycarbonyl)-3-methyl-7H-dibenz(f,ij)isoquinoline-2,7(3H)-dione
Systematic Name English
3H-Naphtho(1,2,3-de)quinoline-1-carboxylic acid, 6-bromo-2,7-dihydro-3-methyl-2,7-dioxo-, ethyl ester
Systematic Name English
Ethyl 6-bromo-2,7-dihydro-3-methyl-2,7-dioxo-3H-naphtho[1,2,3-de]quinoline-1-carboxylate
Systematic Name English
Code System Code Type Description
CAS
71205-38-4
Created by admin on Tue Apr 01 20:12:33 GMT 2025 , Edited by admin on Tue Apr 01 20:12:33 GMT 2025
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FDA UNII
7WA6WHH8WH
Created by admin on Tue Apr 01 20:12:33 GMT 2025 , Edited by admin on Tue Apr 01 20:12:33 GMT 2025
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NSC
227204
Created by admin on Tue Apr 01 20:12:33 GMT 2025 , Edited by admin on Tue Apr 01 20:12:33 GMT 2025
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EPA CompTox
DTXSID9072288
Created by admin on Tue Apr 01 20:12:33 GMT 2025 , Edited by admin on Tue Apr 01 20:12:33 GMT 2025
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PUBCHEM
72580
Created by admin on Tue Apr 01 20:12:33 GMT 2025 , Edited by admin on Tue Apr 01 20:12:33 GMT 2025
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