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Details

Stereochemistry ACHIRAL
Molecular Formula C16H14N2O7
Molecular Weight 346.2916
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of NCX-4050

SMILES

CC(=O)OC1=CC=CC=C1C(=O)OCC2=NC(CO[N+]([O-])=O)=CC=C2

InChI

InChIKey=FWVBLUDIAWAMAJ-UHFFFAOYSA-N
InChI=1S/C16H14N2O7/c1-11(19)25-15-8-3-2-7-14(15)16(20)23-9-12-5-4-6-13(17-12)10-24-18(21)22/h2-8H,9-10H2,1H3

HIDE SMILES / InChI

Molecular Formula C16H14N2O7
Molecular Weight 346.2916
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 18:26:51 GMT 2023
Edited
by admin
on Sat Dec 16 18:26:51 GMT 2023
Record UNII
EWV5CYM7FS
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NCX-4050
Code English
BENZOIC ACID, 2-(ACETYLOXY)-, (6-((NITROOXY)METHYL)-2-PYRIDINYL)METHYL ESTER
Systematic Name English
2-ACETYLOXYBENZOIC ACID (6-(NITROOXYMETHYL)-2-PYRIDINYL)METHYL ESTER
Systematic Name English
Code System Code Type Description
FDA UNII
EWV5CYM7FS
Created by admin on Sat Dec 16 18:26:51 GMT 2023 , Edited by admin on Sat Dec 16 18:26:51 GMT 2023
PRIMARY
PUBCHEM
9866138
Created by admin on Sat Dec 16 18:26:51 GMT 2023 , Edited by admin on Sat Dec 16 18:26:51 GMT 2023
PRIMARY
CAS
290335-23-8
Created by admin on Sat Dec 16 18:26:51 GMT 2023 , Edited by admin on Sat Dec 16 18:26:51 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY