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Details

Stereochemistry ACHIRAL
Molecular Formula C20H17N3O4
Molecular Weight 363.3667
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4,11-Diamino-2-(2-methylpropyl)-1H-naphth[2,3-f]isoindole-1,3,5,10(2H)-tetrone

SMILES

CC(C)CN1C(=O)C2=C(C1=O)C(N)=C3C(=O)C4=C(C=CC=C4)C(=O)C3=C2N

InChI

InChIKey=HDKCUVFLXISKKK-UHFFFAOYSA-N
InChI=1S/C20H17N3O4/c1-8(2)7-23-19(26)13-14(20(23)27)16(22)12-11(15(13)21)17(24)9-5-3-4-6-10(9)18(12)25/h3-6,8H,7,21-22H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C20H17N3O4
Molecular Weight 363.3667
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 19:17:12 GMT 2025
Edited
by admin
on Tue Apr 01 19:17:12 GMT 2025
Record UNII
CD2MR78LUY
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1H-Naphth[2,3-f]isoindole-1,3,5,10(2H)-tetrone, 4,11-diamino-2-(2-methylpropyl)-
Preferred Name English
4,11-Diamino-2-(2-methylpropyl)-1H-naphth[2,3-f]isoindole-1,3,5,10(2H)-tetrone
Systematic Name English
Code System Code Type Description
CAS
6647-27-4
Created by admin on Tue Apr 01 19:17:12 GMT 2025 , Edited by admin on Tue Apr 01 19:17:12 GMT 2025
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PUBCHEM
81154
Created by admin on Tue Apr 01 19:17:12 GMT 2025 , Edited by admin on Tue Apr 01 19:17:12 GMT 2025
PRIMARY
EPA CompTox
DTXSID80216682
Created by admin on Tue Apr 01 19:17:12 GMT 2025 , Edited by admin on Tue Apr 01 19:17:12 GMT 2025
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FDA UNII
CD2MR78LUY
Created by admin on Tue Apr 01 19:17:12 GMT 2025 , Edited by admin on Tue Apr 01 19:17:12 GMT 2025
PRIMARY
ECHA (EC/EINECS)
229-665-7
Created by admin on Tue Apr 01 19:17:12 GMT 2025 , Edited by admin on Tue Apr 01 19:17:12 GMT 2025
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