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Details

Stereochemistry RACEMIC
Molecular Formula C4H6N2O2
Molecular Weight 114.1026
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-CYANOALANINE

SMILES

NC(CC#N)C(O)=O

InChI

InChIKey=BXRLWGXPSRYJDZ-UHFFFAOYSA-N
InChI=1S/C4H6N2O2/c5-2-1-3(6)4(7)8/h3H,1,6H2,(H,7,8)

HIDE SMILES / InChI

Molecular Formula C4H6N2O2
Molecular Weight 114.1026
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Record UNII
NGZ6PU7PK7
Record Status Validated (UNII)
Record Version