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Details

Stereochemistry ACHIRAL
Molecular Formula C20H32N2O6
Molecular Weight 396.4779
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2,4,6-TRIHYDROXY-3-NITRO-N-TRIDECYLBENZAMIDE

SMILES

CCCCCCCCCCCCCNC(=O)C1=C(O)C(=C(O)C=C1O)[N+]([O-])=O

InChI

InChIKey=MSWMANFKQVMQAR-UHFFFAOYSA-N
InChI=1S/C20H32N2O6/c1-2-3-4-5-6-7-8-9-10-11-12-13-21-20(26)17-15(23)14-16(24)18(19(17)25)22(27)28/h14,23-25H,2-13H2,1H3,(H,21,26)

HIDE SMILES / InChI

Molecular Formula C20H32N2O6
Molecular Weight 396.4779
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 Wed Apr 02 06:40:36 GMT 2025
Edited
by admin
on Wed Apr 02 06:40:36 GMT 2025
Record UNII
JCG3XJ6USM
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
RD2-4083
Preferred Name English
2,4,6-TRIHYDROXY-3-NITRO-N-TRIDECYLBENZAMIDE
Systematic Name English
3-NITRO-2,4,6-TRIS(OXIDANYL)-N-TRIDECYL-BENZAMIDE
Systematic Name English
BENZAMIDE, 2,4,6-TRIHYDROXY-3-NITRO-N-TRIDECYL-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID50333097
Created by admin on Wed Apr 02 06:40:36 GMT 2025 , Edited by admin on Wed Apr 02 06:40:36 GMT 2025
PRIMARY
CAS
126395-25-3
Created by admin on Wed Apr 02 06:40:36 GMT 2025 , Edited by admin on Wed Apr 02 06:40:36 GMT 2025
PRIMARY
PUBCHEM
482191
Created by admin on Wed Apr 02 06:40:36 GMT 2025 , Edited by admin on Wed Apr 02 06:40:36 GMT 2025
PRIMARY
FDA UNII
JCG3XJ6USM
Created by admin on Wed Apr 02 06:40:36 GMT 2025 , Edited by admin on Wed Apr 02 06:40:36 GMT 2025
PRIMARY