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

Details

Stereochemistry ACHIRAL
Molecular Formula C36H16Cl2N2O4
Molecular Weight 611.429
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PIGMENT RED 189

SMILES

ClC1=CC=C(C=C1)N2C(=O)C3=CC=C4C5=C6C(=CC=C7C(=O)N(C8=CC=C(Cl)C=C8)C(=O)C(C=C5)=C67)C9=C4C3=C(C=C9)C2=O

InChI

InChIKey=ILYBWLBYEIZMCE-UHFFFAOYSA-N
InChI=1S/C36H16Cl2N2O4/c37-17-1-5-19(6-2-17)39-33(41)25-13-9-21-23-11-15-27-32-28(36(44)40(35(27)43)20-7-3-18(38)4-8-20)16-12-24(30(23)32)22-10-14-26(34(39)42)31(25)29(21)22/h1-16H

HIDE SMILES / InChI

Molecular Formula C36H16Cl2N2O4
Molecular Weight 611.429
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 19:35:45 GMT 2025
Edited
by admin
on Tue Apr 01 19:35:45 GMT 2025
Record UNII
NU8QTL2ZHB
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PIGMENT RED 189
Common Name English
C.I. PIGMENT RED 189
Preferred Name English
7,18-BIS(4-CHLOROPHENYL)-7,18-DIAZAHEPTACYCLO(14.6.2.22,5.03,12.04,9.013,23.020,24)HEXACOSA-1(23),2,4,9,11,13,15,20(24),21,25-DECAENE-6,8,17,19-TETRONE
Systematic Name English
VAT RED 32
Common Name English
2,9-BIS(4-CHLOROPHENYL)ANTHRA(2,1,9-DEF:6,5,10-D'E'F')DIISOQUINOLINE-1,3,8,10(2H,9H)-TETRONE
Systematic Name English
ANTHRA(2,1,9-DEF:6,5,10-D'E'F')DIISOQUINOLINE-1,3,8,10(2H,9H)-TETRONE, 2,9-BIS(4-CHLOROPHENYL)-
Systematic Name English
Code System Code Type Description
PUBCHEM
75415
Created by admin on Tue Apr 01 19:35:45 GMT 2025 , Edited by admin on Tue Apr 01 19:35:45 GMT 2025
PRIMARY
EPA CompTox
DTXSID4062357
Created by admin on Tue Apr 01 19:35:45 GMT 2025 , Edited by admin on Tue Apr 01 19:35:45 GMT 2025
PRIMARY
CAS
2379-77-3
Created by admin on Tue Apr 01 19:35:45 GMT 2025 , Edited by admin on Tue Apr 01 19:35:45 GMT 2025
PRIMARY
ECHA (EC/EINECS)
219-166-2
Created by admin on Tue Apr 01 19:35:45 GMT 2025 , Edited by admin on Tue Apr 01 19:35:45 GMT 2025
PRIMARY
FDA UNII
NU8QTL2ZHB
Created by admin on Tue Apr 01 19:35:45 GMT 2025 , Edited by admin on Tue Apr 01 19:35:45 GMT 2025
PRIMARY