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Details

Stereochemistry ACHIRAL
Molecular Formula C39H38ClN2O6S2.Na
Molecular Weight 753.302
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of ACID GREEN 22

SMILES

[Na+].CCN(CC1=CC=CC(=C1)S([O-])(=O)=O)C2=CC=C(C(C)=C2)C(\C3=CC=CC=C3Cl)=C4/C=C\C(\C=C4C)=[N+](\CC)CC5=CC=CC(=C5)S([O-])(=O)=O

InChI

InChIKey=AYQGOOLZDOHXAY-UHFFFAOYSA-M
InChI=1S/C39H39ClN2O6S2.Na/c1-5-41(25-29-11-9-13-33(23-29)49(43,44)45)31-17-19-35(27(3)21-31)39(37-15-7-8-16-38(37)40)36-20-18-32(22-28(36)4)42(6-2)26-30-12-10-14-34(24-30)50(46,47)48;/h7-24H,5-6,25-26H2,1-4H3,(H-,43,44,45,46,47,48);/q;+1/p-1

HIDE SMILES / InChI

Molecular Formula C39H38ClN2O6S2
Molecular Weight 730.312
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 2
Optical Activity NONE

Molecular Formula Na
Molecular Weight 22.9898
Charge 1
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 11:58:48 GMT 2023
Edited
by admin
on Sat Dec 16 11:58:48 GMT 2023
Record UNII
C86OTQ9YRV
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ACID GREEN 22
Common Name English
C.I. ACID GREEN 22
Common Name English
ACILAN FAST GREEN 10G
Brand Name English
BENZENEMETHANAMINIUM, N-(4-((2-CHLOROPHENYL)(4-(ETHYL((3-SULFOPHENYL)METHYL)AMINO)-2-METHYLPHENYL)METHYLENE)-3-METHYL-2,5-CYCLOHEXADIEN-1-YLIDENE)-N-ETHYL-3-SULFO-, INNER SALT, SODIUM SALT (1:1)
Systematic Name English
CI 42170 [INCI]
Code English
CI 42170
INCI  
INCI  
Official Name English
C.I. ACID GREEN 22, SODIUM SALT
Common Name English
ALKALI FAST GREEN 10G
Brand Name English
C.I. 42170
Code English
Code System Code Type Description
CAS
5863-51-4
Created by admin on Sat Dec 16 11:58:49 GMT 2023 , Edited by admin on Sat Dec 16 11:58:49 GMT 2023
PRIMARY
FDA UNII
C86OTQ9YRV
Created by admin on Sat Dec 16 11:58:49 GMT 2023 , Edited by admin on Sat Dec 16 11:58:49 GMT 2023
PRIMARY
EPA CompTox
DTXSID40974175
Created by admin on Sat Dec 16 11:58:49 GMT 2023 , Edited by admin on Sat Dec 16 11:58:49 GMT 2023
PRIMARY
PUBCHEM
6453667
Created by admin on Sat Dec 16 11:58:49 GMT 2023 , Edited by admin on Sat Dec 16 11:58:49 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE