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Details

Stereochemistry ABSOLUTE
Molecular Formula C22H24ClF3N2O2
Molecular Weight 440.886
Optical Activity ( + )
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Selonabant

SMILES

CC(C)(C)NC(=O)N1CC(C1)O[C@H](C2=CC=C(Cl)C=C2)C3=CC=CC=C3C(F)(F)F

InChI

InChIKey=BNLYOVHLLDBOFZ-LJQANCHMSA-N
InChI=1S/C22H24ClF3N2O2/c1-21(2,3)27-20(29)28-12-16(13-28)30-19(14-8-10-15(23)11-9-14)17-6-4-5-7-18(17)22(24,25)26/h4-11,16,19H,12-13H2,1-3H3,(H,27,29)/t19-/m1/s1

HIDE SMILES / InChI

Molecular Formula C22H24ClF3N2O2
Molecular Weight 440.886
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
4RNU8C6XXW
Record Status Validated (UNII)
Record Version