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

Details

Stereochemistry ACHIRAL
Molecular Formula C22H17NO3
Molecular Weight 343.3753
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-Methoxy-4-[(4-methylphenyl)amino]-9,10-anthracenedione

SMILES

COC1=CC=C(NC2=CC=C(C)C=C2)C3=C1C(=O)C4=CC=CC=C4C3=O

InChI

InChIKey=BWOZYUXKRAILOH-UHFFFAOYSA-N
InChI=1S/C22H17NO3/c1-13-7-9-14(10-8-13)23-17-11-12-18(26-2)20-19(17)21(24)15-5-3-4-6-16(15)22(20)25/h3-12,23H,1-2H3

HIDE SMILES / InChI

Molecular Formula C22H17NO3
Molecular Weight 343.3753
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 19:27:36 GMT 2025
Edited
by admin
on Tue Apr 01 19:27:36 GMT 2025
Record UNII
ZPD43K5H8M
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-Methoxy-4-[(4-methylphenyl)amino]-9,10-anthracenedione
Systematic Name English
9,10-Anthracenedione, 1-methoxy-4-[(4-methylphenyl)amino]-
Preferred Name English
Code System Code Type Description
CAS
67905-52-6
Created by admin on Tue Apr 01 19:27:36 GMT 2025 , Edited by admin on Tue Apr 01 19:27:36 GMT 2025
PRIMARY
EPA CompTox
DTXSID0070811
Created by admin on Tue Apr 01 19:27:36 GMT 2025 , Edited by admin on Tue Apr 01 19:27:36 GMT 2025
PRIMARY
FDA UNII
ZPD43K5H8M
Created by admin on Tue Apr 01 19:27:36 GMT 2025 , Edited by admin on Tue Apr 01 19:27:36 GMT 2025
PRIMARY
ECHA (EC/EINECS)
267-673-2
Created by admin on Tue Apr 01 19:27:36 GMT 2025 , Edited by admin on Tue Apr 01 19:27:36 GMT 2025
PRIMARY
PUBCHEM
106049
Created by admin on Tue Apr 01 19:27:36 GMT 2025 , Edited by admin on Tue Apr 01 19:27:36 GMT 2025
PRIMARY