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Details

Stereochemistry ACHIRAL
Molecular Formula C22H23N5O6S
Molecular Weight 485.513
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 2,2'-[[3-Methyl-4-[(6-nitrobenzothiazol-2-yl)azo]phenyl]imino]bisethyl diacetate

SMILES

CC(=O)OCCN(CCOC(C)=O)C1=CC(C)=C(C=C1)\N=N\C2=NC3=CC=C(C=C3S2)[N+]([O-])=O

InChI

InChIKey=QWTGQMDYCRRUTB-OCOZRVBESA-N
InChI=1S/C22H23N5O6S/c1-14-12-17(26(8-10-32-15(2)28)9-11-33-16(3)29)4-6-19(14)24-25-22-23-20-7-5-18(27(30)31)13-21(20)34-22/h4-7,12-13H,8-11H2,1-3H3/b25-24+

HIDE SMILES / InChI

Approval Year

Name Type Language
2,2'-[[3-Methyl-4-[(6-nitrobenzothiazol-2-yl)azo]phenyl]imino]bisethyl diacetate
Systematic Name English
Ethanol, 2,2′-[[3-methyl-4-[(6-nitro-2-benzothiazolyl)azo]phenyl]imino]bis-, diacetate (ester)
Systematic Name English
Ethanol, 2,2′-[[3-methyl-4-[2-(6-nitro-2-benzothiazolyl)diazenyl]phenyl]imino]bis-, 1,1′-diacetate
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
274-731-0
Created by admin on Sat Dec 16 13:24:59 GMT 2023 , Edited by admin on Sat Dec 16 13:24:59 GMT 2023
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CAS
70660-53-6
Created by admin on Sat Dec 16 13:24:59 GMT 2023 , Edited by admin on Sat Dec 16 13:24:59 GMT 2023
PRIMARY
FDA UNII
F4ZHU3B7ZD
Created by admin on Sat Dec 16 13:24:59 GMT 2023 , Edited by admin on Sat Dec 16 13:24:59 GMT 2023
PRIMARY
EPA CompTox
DTXSID2072093
Created by admin on Sat Dec 16 13:24:59 GMT 2023 , Edited by admin on Sat Dec 16 13:24:59 GMT 2023
PRIMARY
PUBCHEM
116780
Created by admin on Sat Dec 16 13:24:59 GMT 2023 , Edited by admin on Sat Dec 16 13:24:59 GMT 2023
PRIMARY