U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C16H14N2O6
Molecular Weight 330.2922
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-ACETOXY-N-((4-NITROBENZYL)OXY)BENZAMIDE

SMILES

CC(=O)ON(OCC1=CC=C(C=C1)[N+]([O-])=O)C(=O)C2=CC=CC=C2

InChI

InChIKey=BIPFSLROIPYVDR-UHFFFAOYSA-N
InChI=1S/C16H14N2O6/c1-12(19)24-18(16(20)14-5-3-2-4-6-14)23-11-13-7-9-15(10-8-13)17(21)22/h2-10H,11H2,1H3

HIDE SMILES / InChI

Molecular Formula C16H14N2O6
Molecular Weight 330.2922
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 08:50:29 GMT 2023
Edited
by admin
on Sat Dec 16 08:50:29 GMT 2023
Record UNII
8K5U3JED6A
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-ACETOXY-N-((4-NITROBENZYL)OXY)BENZAMIDE
Systematic Name English
ACETIC ACID, BENZOYL((4-NITROPHENYL)METHOXY)AZANYL ESTER
Common Name English
BENZAMIDE, N-(ACETYLOXY)-N-((4-NITROPHENYL)METHOXY)-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID70160988
Created by admin on Sat Dec 16 08:50:29 GMT 2023 , Edited by admin on Sat Dec 16 08:50:29 GMT 2023
PRIMARY
CAS
139259-98-6
Created by admin on Sat Dec 16 08:50:29 GMT 2023 , Edited by admin on Sat Dec 16 08:50:29 GMT 2023
PRIMARY
FDA UNII
8K5U3JED6A
Created by admin on Sat Dec 16 08:50:29 GMT 2023 , Edited by admin on Sat Dec 16 08:50:29 GMT 2023
PRIMARY
PUBCHEM
3025745
Created by admin on Sat Dec 16 08:50:29 GMT 2023 , Edited by admin on Sat Dec 16 08:50:29 GMT 2023
PRIMARY