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Details

Stereochemistry ACHIRAL
Molecular Formula C12H16N2O3
Molecular Weight 236.267
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-(4-BUTYL-2-NITROPHENYL)ACETAMIDE

SMILES

CCCCC1=CC=C(NC(C)=O)C(=C1)[N+]([O-])=O

InChI

InChIKey=XXHAVEZHZLGQOE-UHFFFAOYSA-N
InChI=1S/C12H16N2O3/c1-3-4-5-10-6-7-11(13-9(2)15)12(8-10)14(16)17/h6-8H,3-5H2,1-2H3,(H,13,15)

HIDE SMILES / InChI

Molecular Formula C12H16N2O3
Molecular Weight 236.267
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 12:11:50 GMT 2023
Edited
by admin
on Sat Dec 16 12:11:50 GMT 2023
Record UNII
GQ46UP59Q3
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-(4-BUTYL-2-NITROPHENYL)ACETAMIDE
Systematic Name English
ACETAMIDE, N-(4-BUTYL-2-NITROPHENYL)-
Systematic Name English
Code System Code Type Description
PUBCHEM
77228
Created by admin on Sat Dec 16 12:11:50 GMT 2023 , Edited by admin on Sat Dec 16 12:11:50 GMT 2023
PRIMARY
ECHA (EC/EINECS)
222-915-6
Created by admin on Sat Dec 16 12:11:50 GMT 2023 , Edited by admin on Sat Dec 16 12:11:50 GMT 2023
PRIMARY
EPA CompTox
DTXSID8074601
Created by admin on Sat Dec 16 12:11:50 GMT 2023 , Edited by admin on Sat Dec 16 12:11:50 GMT 2023
PRIMARY
CAS
3663-21-6
Created by admin on Sat Dec 16 12:11:50 GMT 2023 , Edited by admin on Sat Dec 16 12:11:50 GMT 2023
PRIMARY
FDA UNII
GQ46UP59Q3
Created by admin on Sat Dec 16 12:11:50 GMT 2023 , Edited by admin on Sat Dec 16 12:11:50 GMT 2023
PRIMARY