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Details

Stereochemistry ACHIRAL
Molecular Formula C10H14N4O7
Molecular Weight 302.2408
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of NCX-972

SMILES

CC1=NC=C(N1CCOC(=O)CCCO[N+]([O-])=O)[N+]([O-])=O

InChI

InChIKey=MOJUOMCSNQJLNU-UHFFFAOYSA-N
InChI=1S/C10H14N4O7/c1-8-11-7-9(13(16)17)12(8)4-6-20-10(15)3-2-5-21-14(18)19/h7H,2-6H2,1H3

HIDE SMILES / InChI

Molecular Formula C10H14N4O7
Molecular Weight 302.2408
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 10:54:43 GMT 2023
Edited
by admin
on Sat Dec 16 10:54:43 GMT 2023
Record UNII
U74DZZ4B72
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NCX-972
Code English
BUTANOIC ACID, 4-(NITROOXY)-, 2-(2-METHYL-5-NITRO-1H-IMIDAZOL-1-YL)ETHYL ESTER
Systematic Name English
2-(2-METHYL-5-NITRO-1H-IMIDAZOL-1-YL)ETHYL 4-(NITROOXY)BUTANOATE
Systematic Name English
NCX972
Code English
Code System Code Type Description
FDA UNII
U74DZZ4B72
Created by admin on Sat Dec 16 10:54:43 GMT 2023 , Edited by admin on Sat Dec 16 10:54:43 GMT 2023
PRIMARY
CAS
352464-62-1
Created by admin on Sat Dec 16 10:54:43 GMT 2023 , Edited by admin on Sat Dec 16 10:54:43 GMT 2023
PRIMARY
PUBCHEM
9861194
Created by admin on Sat Dec 16 10:54:43 GMT 2023 , Edited by admin on Sat Dec 16 10:54:43 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY