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Details

Stereochemistry ABSOLUTE
Molecular Formula C20H28FN3O3
Molecular Weight 377.453
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5F-EMB-PINACA

SMILES

CCOC(=O)[C@@H](NC(=O)C1=NN(CCCCCF)C2=CC=CC=C12)C(C)C

InChI

InChIKey=YWSYUMWEKPNAHT-KRWDZBQOSA-N
InChI=1S/C20H28FN3O3/c1-4-27-20(26)17(14(2)3)22-19(25)18-15-10-6-7-11-16(15)24(23-18)13-9-5-8-12-21/h6-7,10-11,14,17H,4-5,8-9,12-13H2,1-3H3,(H,22,25)/t17-/m0/s1

HIDE SMILES / InChI

Molecular Formula C20H28FN3O3
Molecular Weight 377.453
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
64OSW0N4YB
Record Status Validated (UNII)
Record Version