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Details

Stereochemistry RACEMIC
Molecular Formula C29H34N2O
Molecular Weight 426.5931
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TRANS-3-BENZYL FENTANYL

SMILES

CCC(=O)N([C@@H]1CCN(CCC2=CC=CC=C2)C[C@H]1CC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChIKey=FZYCKZRWWLVCJY-IXCJQBJRSA-N
InChI=1S/C29H34N2O/c1-2-29(32)31(27-16-10-5-11-17-27)28-19-21-30(20-18-24-12-6-3-7-13-24)23-26(28)22-25-14-8-4-9-15-25/h3-17,26,28H,2,18-23H2,1H3/t26-,28-/m1/s1

HIDE SMILES / InChI

Molecular Formula C29H34N2O
Molecular Weight 426.5931
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
E6M66DZ3JG
Record Status Validated (UNII)
Record Version