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Details

Stereochemistry RACEMIC
Molecular Formula C21H25NO2
Molecular Weight 323.4287
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-HYDROXY-1-METHYL-4-(4-METHYLPHENYL)-3-PIPERIDYL 4-METHYLPHENYL KETONE

SMILES

CN1CC[C@](O)([C@@H](C1)C(=O)C2=CC=C(C)C=C2)C3=CC=C(C)C=C3

InChI

InChIKey=SWFNNRQTSSTAGB-PZJWPPBQSA-N
InChI=1S/C21H25NO2/c1-15-4-8-17(9-5-15)20(23)19-14-22(3)13-12-21(19,24)18-10-6-16(2)7-11-18/h4-11,19,24H,12-14H2,1-3H3/t19-,21+/m0/s1

HIDE SMILES / InChI

Molecular Formula C21H25NO2
Molecular Weight 323.4287
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 Sat Dec 16 18:06:03 GMT 2023
Edited
by admin
on Sat Dec 16 18:06:03 GMT 2023
Record UNII
JYH5V2N2LA
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-HYDROXY-1-METHYL-4-(4-METHYLPHENYL)-3-PIPERIDYL 4-METHYLPHENYL KETONE
Systematic Name English
REL-((3R,4S)-4-HYDROXY-1-METHYL-4-(4-METHYLPHENYL)-3-PIPERIDINYL)(4-METHYLPHENYL)METHANONE
Systematic Name English
Methanone, [(3R,4S)-4-hydroxy-1-methyl-4-(4-methylphenyl)-3-piperidinyl](4-methylphenyl)-, rel-
Systematic Name English
Code System Code Type Description
WIKIPEDIA
4-Hydroxy-1-methyl-4-(4-methylphenyl)-3-piperidyl 4-methylphenyl ketone
Created by admin on Sat Dec 16 18:06:03 GMT 2023 , Edited by admin on Sat Dec 16 18:06:03 GMT 2023
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CAS
224948-87-2
Created by admin on Sat Dec 16 18:06:03 GMT 2023 , Edited by admin on Sat Dec 16 18:06:03 GMT 2023
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FDA UNII
JYH5V2N2LA
Created by admin on Sat Dec 16 18:06:03 GMT 2023 , Edited by admin on Sat Dec 16 18:06:03 GMT 2023
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EPA CompTox
DTXSID001336012
Created by admin on Sat Dec 16 18:06:03 GMT 2023 , Edited by admin on Sat Dec 16 18:06:03 GMT 2023
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PUBCHEM
9905279
Created by admin on Sat Dec 16 18:06:03 GMT 2023 , Edited by admin on Sat Dec 16 18:06:03 GMT 2023
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