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Details

Stereochemistry ACHIRAL
Molecular Formula C27H26ClN5O7
Molecular Weight 567.978
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of Benzamide, N-[5-[bis[2-(acetyloxy)ethyl]amino]-2-[(2-chloro-4-nitrophenyl)azo]phenyl]-

SMILES

CC(=O)OCCN(CCOC(C)=O)C1=CC=C(\N=N\C2=CC=C(C=C2Cl)[N+]([O-])=O)C(NC(=O)C3=CC=CC=C3)=C1

InChI

InChIKey=VICMHNHXHZSEJF-NVQSTNCTSA-N
InChI=1S/C27H26ClN5O7/c1-18(34)39-14-12-32(13-15-40-19(2)35)21-8-11-25(26(17-21)29-27(36)20-6-4-3-5-7-20)31-30-24-10-9-22(33(37)38)16-23(24)28/h3-11,16-17H,12-15H2,1-2H3,(H,29,36)/b31-30+

HIDE SMILES / InChI

Molecular Formula C27H26ClN5O7
Molecular Weight 567.978
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 12:31:01 GMT 2023
Edited
by admin
on Sat Dec 16 12:31:01 GMT 2023
Record UNII
6FGH2G4NH8
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Benzamide, N-[5-[bis[2-(acetyloxy)ethyl]amino]-2-[(2-chloro-4-nitrophenyl)azo]phenyl]-
Systematic Name English
N-[5-[Bis[2-(acetyloxy)ethyl]amino]-2-[2-(2-chloro-4-nitrophenyl)diazenyl]phenyl]benzamide
Systematic Name English
Benzamide, N-[5-[bis[2-(acetyloxy)ethyl]amino]-2-[2-(2-chloro-4-nitrophenyl)diazenyl]phenyl]-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID6067628
Created by admin on Sat Dec 16 12:31:01 GMT 2023 , Edited by admin on Sat Dec 16 12:31:01 GMT 2023
PRIMARY
CAS
31501-01-6
Created by admin on Sat Dec 16 12:31:01 GMT 2023 , Edited by admin on Sat Dec 16 12:31:01 GMT 2023
PRIMARY
FDA UNII
6FGH2G4NH8
Created by admin on Sat Dec 16 12:31:01 GMT 2023 , Edited by admin on Sat Dec 16 12:31:01 GMT 2023
PRIMARY
ECHA (EC/EINECS)
250-660-0
Created by admin on Sat Dec 16 12:31:01 GMT 2023 , Edited by admin on Sat Dec 16 12:31:01 GMT 2023
PRIMARY