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Details

Stereochemistry ACHIRAL
Molecular Formula C18H14BrN5O4
Molecular Weight 444.239
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 4-((2-BROMO-4,6-DINITROPHENYL)AZO)-N-ETHYLNAPHTHALEN-1-AMINE

SMILES

CCNC1=C2C=CC=CC2=C(C=C1)\N=N\C3=C(Br)C=C(C=C3[N+]([O-])=O)[N+]([O-])=O

InChI

InChIKey=ZZOIADZSKZGBIZ-QURGRASLSA-N
InChI=1S/C18H14BrN5O4/c1-2-20-15-7-8-16(13-6-4-3-5-12(13)15)21-22-18-14(19)9-11(23(25)26)10-17(18)24(27)28/h3-10,20H,2H2,1H3/b22-21+

HIDE SMILES / InChI

Molecular Formula C18H14BrN5O4
Molecular Weight 444.239
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 12:18:31 GMT 2023
Edited
by admin
on Sat Dec 16 12:18:31 GMT 2023
Record UNII
03JP25BT5R
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-((2-BROMO-4,6-DINITROPHENYL)AZO)-N-ETHYLNAPHTHALEN-1-AMINE
Systematic Name English
1-NAPHTHALENAMINE, 4-((2-BROMO-4,6-DINITROPHENYL)AZO)-N-ETHYL-
Systematic Name English
Code System Code Type Description
CAS
68084-18-4
Created by admin on Sat Dec 16 12:18:31 GMT 2023 , Edited by admin on Sat Dec 16 12:18:31 GMT 2023
PRIMARY
EPA CompTox
DTXSID7071072
Created by admin on Sat Dec 16 12:18:31 GMT 2023 , Edited by admin on Sat Dec 16 12:18:31 GMT 2023
PRIMARY
FDA UNII
03JP25BT5R
Created by admin on Sat Dec 16 12:18:31 GMT 2023 , Edited by admin on Sat Dec 16 12:18:31 GMT 2023
PRIMARY
ECHA (EC/EINECS)
268-430-3
Created by admin on Sat Dec 16 12:18:31 GMT 2023 , Edited by admin on Sat Dec 16 12:18:31 GMT 2023
PRIMARY