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Details

Stereochemistry ACHIRAL
Molecular Formula C44H24N4O8
Molecular Weight 736.6834
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N,N?-(9,10-Dihydro-9,10-dioxo-1,5-anthracenediyl)bis[1-amino-9,10-dihydro-9,10-dioxo-2-anthracenecarboxamide]

SMILES

NC1=C(C=CC2=C1C(=O)C3=C(C=CC=C3)C2=O)C(=O)NC4=CC=CC5=C4C(=O)C6=CC=CC(NC(=O)C7=C(N)C8=C(C=C7)C(=O)C9=C(C=CC=C9)C8=O)=C6C5=O

InChI

InChIKey=CDUBTZSRLPGVRQ-UHFFFAOYSA-N
InChI=1S/C44H24N4O8/c45-35-27(17-15-25-33(35)39(51)21-9-3-1-7-19(21)37(25)49)43(55)47-29-13-5-11-23-31(29)41(53)24-12-6-14-30(32(24)42(23)54)48-44(56)28-18-16-26-34(36(28)46)40(52)22-10-4-2-8-20(22)38(26)50/h1-18H,45-46H2,(H,47,55)(H,48,56)

HIDE SMILES / InChI

Molecular Formula C44H24N4O8
Molecular Weight 736.6834
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 19:12:54 GMT 2025
Edited
by admin
on Tue Apr 01 19:12:54 GMT 2025
Record UNII
MYG434U6EP
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N,N?-(9,10-Dihydro-9,10-dioxo-1,5-anthracenediyl)bis[1-amino-9,10-dihydro-9,10-dioxo-2-anthracenecarboxamide]
Systematic Name English
2-Anthracenecarboxamide, N,N?-(9,10-dihydro-9,10-dioxo-1,5-anthracenediyl)bis[1-amino-9,10-dihydro-9,10-dioxo-
Preferred Name English
Code System Code Type Description
EPA CompTox
DTXSID2071782
Created by admin on Tue Apr 01 19:12:54 GMT 2025 , Edited by admin on Tue Apr 01 19:12:54 GMT 2025
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CAS
68845-15-8
Created by admin on Tue Apr 01 19:12:54 GMT 2025 , Edited by admin on Tue Apr 01 19:12:54 GMT 2025
PRIMARY
ECHA (EC/EINECS)
272-452-9
Created by admin on Tue Apr 01 19:12:54 GMT 2025 , Edited by admin on Tue Apr 01 19:12:54 GMT 2025
PRIMARY
PUBCHEM
173089
Created by admin on Tue Apr 01 19:12:54 GMT 2025 , Edited by admin on Tue Apr 01 19:12:54 GMT 2025
PRIMARY
FDA UNII
MYG434U6EP
Created by admin on Tue Apr 01 19:12:54 GMT 2025 , Edited by admin on Tue Apr 01 19:12:54 GMT 2025
PRIMARY