U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C28H16Cl2N2O2
Molecular Weight 483.345
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of N-[6-[[chloro(phenyl)methylidene]amino]-9,10-dioxoanthracen-2-yl]benzenecarboximidoylchloride

SMILES

Cl\C(C1=CC=CC=C1)=N/C2=CC=C3C(=O)C4=CC(=CC=C4C(=O)C3=C2)\N=C(/Cl)C5=CC=CC=C5

InChI

InChIKey=SXMJAAZDNXOTAM-YDWWYXFJSA-N
InChI=1S/C28H16Cl2N2O2/c29-27(17-7-3-1-4-8-17)31-19-11-13-21-23(15-19)25(33)22-14-12-20(16-24(22)26(21)34)32-28(30)18-9-5-2-6-10-18/h1-16H/b31-27-,32-28-

HIDE SMILES / InChI

Molecular Formula C28H16Cl2N2O2
Molecular Weight 483.345
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 2
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 12:09:20 GMT 2023
Edited
by admin
on Sat Dec 16 12:09:20 GMT 2023
Record UNII
C6CX34C6YE
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-[6-[[chloro(phenyl)methylidene]amino]-9,10-dioxoanthracen-2-yl]benzenecarboximidoylchloride
Systematic Name English
Benzenecarboximidoyl chloride, N,N′-(9,10-dihydro-9,10-dioxo-2,6-anthracenediyl)bis-
Systematic Name English
N,N′-(9,10-Dihydro-9,10-dioxo-2,6-anthracenediyl)bis[benzenecarboximidoyl chloride]
Systematic Name English
n,n'-dibenzimidoyldichloride
Common Name English
Code System Code Type Description
CAS
66214-41-3
Created by admin on Sat Dec 16 12:09:20 GMT 2023 , Edited by admin on Sat Dec 16 12:09:20 GMT 2023
PRIMARY
EPA CompTox
DTXSID6070433
Created by admin on Sat Dec 16 12:09:20 GMT 2023 , Edited by admin on Sat Dec 16 12:09:20 GMT 2023
PRIMARY
ECHA (EC/EINECS)
266-242-6
Created by admin on Sat Dec 16 12:09:20 GMT 2023 , Edited by admin on Sat Dec 16 12:09:20 GMT 2023
PRIMARY
FDA UNII
C6CX34C6YE
Created by admin on Sat Dec 16 12:09:20 GMT 2023 , Edited by admin on Sat Dec 16 12:09:20 GMT 2023
PRIMARY