2,2'-[[3-Methyl-4-[(6-nitrobenzothiazol-2-yl)azo]phenyl]imino]bisethyl diacetate

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

Structure Search

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

Molecular Formula	C22H23N5O6S
Molecular Weight	485.513
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 13:24:59 GMT 2023` Edited by `admin` on `Sat Dec 16 13:24:59 GMT 2023`
Record UNII	F4ZHU3B7ZD
Record Status	`Validated (UNII)`
Record Version

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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