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Details

Stereochemistry RACEMIC
Molecular Formula C18H25NO2
Molecular Weight 287.3966
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ALLYLPRODINE, .BETA.-

SMILES

CCC(=O)O[C@]1(CCN(C)C[C@@H]1CC=C)C2=CC=CC=C2

InChI

InChIKey=KGYFOSCXVAXULR-FUHWJXTLSA-N
InChI=1S/C18H25NO2/c1-4-9-16-14-19(3)13-12-18(16,21-17(20)5-2)15-10-7-6-8-11-15/h4,6-8,10-11,16H,1,5,9,12-14H2,2-3H3/t16-,18+/m0/s1

HIDE SMILES / InChI

Molecular Formula C18H25NO2
Molecular Weight 287.3966
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 17:34:24 GMT 2023
Edited
by admin
on Fri Dec 15 17:34:24 GMT 2023
Record UNII
028U1A6J7B
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ALLYLPRODINE, .BETA.-
Common Name English
.BETA.-ALLYLPRODINE
Common Name English
4-PIPERIDINOL, 1-METHYL-4-PHENYL-3-(2-PROPENYL)-, PROPANOATE (ESTER), TRANS-
Common Name English
(±)-.BETA.-3-ALLYL-1-METHYL-4-PHENYL-4-PIPERIDINYL PROPIONATE
Common Name English
Code System Code Type Description
CAS
53611-19-1
Created by admin on Fri Dec 15 17:34:24 GMT 2023 , Edited by admin on Fri Dec 15 17:34:24 GMT 2023
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FDA UNII
028U1A6J7B
Created by admin on Fri Dec 15 17:34:24 GMT 2023 , Edited by admin on Fri Dec 15 17:34:24 GMT 2023
PRIMARY
EPA CompTox
DTXSID80201856
Created by admin on Fri Dec 15 17:34:24 GMT 2023 , Edited by admin on Fri Dec 15 17:34:24 GMT 2023
PRIMARY
PUBCHEM
12218317
Created by admin on Fri Dec 15 17:34:24 GMT 2023 , Edited by admin on Fri Dec 15 17:34:24 GMT 2023
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