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Details

Stereochemistry RACEMIC
Molecular Formula C26H36N2O4
Molecular Weight 440.575
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-(3,4,5-TMA) Fentanyl

SMILES

CCC(=O)N(C1CCN(CC1)C(C)CC2=CC(OC)=C(OC)C(OC)=C2)C3=CC=CC=C3

InChI

InChIKey=UOWROPJYPQKYER-UHFFFAOYSA-N
InChI=1S/C26H36N2O4/c1-6-25(29)28(21-10-8-7-9-11-21)22-12-14-27(15-13-22)19(2)16-20-17-23(30-3)26(32-5)24(18-20)31-4/h7-11,17-19,22H,6,12-16H2,1-5H3

HIDE SMILES / InChI

Molecular Formula C26H36N2O4
Molecular Weight 440.575
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Record UNII
PS7YNN6AQ2
Record Status Validated (UNII)
Record Version