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Details

Stereochemistry ACHIRAL
Molecular Formula C18H20ClN5O5
Molecular Weight 421.835
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of N-[5-[Bis(2-hydroxyethyl)amino]-2-[(2-chloro-4-nitrophenyl)azo]phenyl]acetamide

SMILES

CC(=O)NC1=C(C=CC(=C1)N(CCO)CCO)\N=N\C2=C(Cl)C=C(C=C2)[N+]([O-])=O

InChI

InChIKey=ORCRYIVAJKZTLW-QURGRASLSA-N
InChI=1S/C18H20ClN5O5/c1-12(27)20-18-11-13(23(6-8-25)7-9-26)2-5-17(18)22-21-16-4-3-14(24(28)29)10-15(16)19/h2-5,10-11,25-26H,6-9H2,1H3,(H,20,27)/b22-21+

HIDE SMILES / InChI

Molecular Formula C18H20ClN5O5
Molecular Weight 421.835
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 Wed Apr 02 21:08:32 GMT 2025
Edited
by admin
on Wed Apr 02 21:08:32 GMT 2025
Record UNII
T7B62LT58A
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-[5-[Bis(2-hydroxyethyl)amino]-2-[(2-chloro-4-nitrophenyl)azo]phenyl]acetamide
Systematic Name English
Acetamide, N-[5-[bis(2-hydroxyethyl)amino]-2-[(2-chloro-4-nitrophenyl)azo]phenyl]-
Preferred Name English
N-[5-[Bis(2-hydroxyethyl)amino]-2-[2-(2-chloro-4-nitrophenyl)diazenyl]phenyl]acetamide
Systematic Name English
Acetamide, N-[5-[bis(2-hydroxyethyl)amino]-2-[2-(2-chloro-4-nitrophenyl)diazenyl]phenyl]-
Systematic Name English
Code System Code Type Description
PUBCHEM
112822
Created by admin on Wed Apr 02 21:08:32 GMT 2025 , Edited by admin on Wed Apr 02 21:08:32 GMT 2025
PRIMARY
FDA UNII
T7B62LT58A
Created by admin on Wed Apr 02 21:08:32 GMT 2025 , Edited by admin on Wed Apr 02 21:08:32 GMT 2025
PRIMARY
ECHA (EC/EINECS)
263-472-9
Created by admin on Wed Apr 02 21:08:32 GMT 2025 , Edited by admin on Wed Apr 02 21:08:32 GMT 2025
PRIMARY
CAS
62257-17-4
Created by admin on Wed Apr 02 21:08:32 GMT 2025 , Edited by admin on Wed Apr 02 21:08:32 GMT 2025
PRIMARY
EPA CompTox
DTXSID4069553
Created by admin on Wed Apr 02 21:08:32 GMT 2025 , Edited by admin on Wed Apr 02 21:08:32 GMT 2025
PRIMARY