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Details

Stereochemistry ACHIRAL
Molecular Formula C26H27N3O2
Molecular Weight 413.5115
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-[[3-(Dimethylamino)propyl]amino]-4-[(4-methylphenyl)amino]anthraquinone

SMILES

CN(C)CCCNC1=CC=C(NC2=CC=C(C)C=C2)C3=C1C(=O)C4=CC=CC=C4C3=O

InChI

InChIKey=FTYQWGDZBXEMPO-UHFFFAOYSA-N
InChI=1S/C26H27N3O2/c1-17-9-11-18(12-10-17)28-22-14-13-21(27-15-6-16-29(2)3)23-24(22)26(31)20-8-5-4-7-19(20)25(23)30/h4-5,7-14,27-28H,6,15-16H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C26H27N3O2
Molecular Weight 413.5115
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 Sat Dec 16 12:24:04 GMT 2023
Edited
by admin
on Sat Dec 16 12:24:04 GMT 2023
Record UNII
UWK39H3RQN
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-[[3-(Dimethylamino)propyl]amino]-4-[(4-methylphenyl)amino]anthraquinone
Systematic Name English
1-[[3-(Dimethylamino)propyl]amino]-4-[(4-methylphenyl)amino]-9,10-anthracenedione
Systematic Name English
9,10-Anthracenedione, 1-[[3-(dimethylamino)propyl]amino]-4-[(4-methylphenyl)amino]-
Systematic Name English
Code System Code Type Description
CAS
25743-94-6
Created by admin on Sat Dec 16 12:24:04 GMT 2023 , Edited by admin on Sat Dec 16 12:24:04 GMT 2023
PRIMARY
EPA CompTox
DTXSID0067133
Created by admin on Sat Dec 16 12:24:04 GMT 2023 , Edited by admin on Sat Dec 16 12:24:04 GMT 2023
PRIMARY
FDA UNII
UWK39H3RQN
Created by admin on Sat Dec 16 12:24:04 GMT 2023 , Edited by admin on Sat Dec 16 12:24:04 GMT 2023
PRIMARY
ECHA (EC/EINECS)
247-226-8
Created by admin on Sat Dec 16 12:24:04 GMT 2023 , Edited by admin on Sat Dec 16 12:24:04 GMT 2023
PRIMARY
PUBCHEM
117621
Created by admin on Sat Dec 16 12:24:04 GMT 2023 , Edited by admin on Sat Dec 16 12:24:04 GMT 2023
PRIMARY