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Details

Stereochemistry ACHIRAL
Molecular Formula C15H12F3N3O
Molecular Weight 307.2705
Optical Activity NONE
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-TRIFLUOROACETYLVARENICLINE

SMILES

FC(F)(F)C(=O)N1C[C@@H]2C[C@H](C1)C3=CC4=C(C=C23)N=CC=N4

InChI

InChIKey=XDLHBWIAJAKYKF-DTORHVGOSA-N
InChI=1S/C15H12F3N3O/c16-15(17,18)14(22)21-6-8-3-9(7-21)11-5-13-12(4-10(8)11)19-1-2-20-13/h1-2,4-5,8-9H,3,6-7H2/t8-,9+

HIDE SMILES / InChI

Molecular Formula C15H12F3N3O
Molecular Weight 307.2705
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
22E2HV68CM
Record Status Validated (UNII)
Record Version