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Details

Stereochemistry ABSOLUTE
Molecular Formula C25H24FNO3
Molecular Weight 405.4614
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (3S,4R)-3-(((1,3-BENZODIOXOL-5-YL)OXY)METHYL)-3-(4'-FLUORO(1,1'-BIPHENYL)-3-YL)PIPERIDINE

SMILES

FC1=CC=C(C=C1)C2=CC=CC(=C2)[C@@H]3CCNC[C@H]3COC4=CC5=C(OCO5)C=C4

InChI

InChIKey=MFUAMYHEVCIZFT-REWPJTCUSA-N
InChI=1S/C25H24FNO3/c26-21-6-4-17(5-7-21)18-2-1-3-19(12-18)23-10-11-27-14-20(23)15-28-22-8-9-24-25(13-22)30-16-29-24/h1-9,12-13,20,23,27H,10-11,14-16H2/t20-,23-/m0/s1

HIDE SMILES / InChI

Molecular Formula C25H24FNO3
Molecular Weight 405.4614
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
NU8M3MB8BU
Record Status Validated (UNII)
Record Version