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Details

Stereochemistry ACHIRAL
Molecular Formula C4H6N4O
Molecular Weight 126.1166
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DIAMINOPYRIMIDINE OXIDE

SMILES

NC1=CC=NC(N)=[N+]1[O-]

InChI

InChIKey=SGHQFNHCCOBUKB-UHFFFAOYSA-N
InChI=1S/C4H6N4O/c5-3-1-2-7-4(6)8(3)9/h1-2H,5H2,(H2,6,7)

HIDE SMILES / InChI

Molecular Formula C4H6N4O
Molecular Weight 126.1166
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Record UNII
1756681479
Record Status Validated (UNII)
Record Version