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Details

Stereochemistry UNKNOWN
Molecular Formula C20H31NO2
Molecular Weight 317.4656
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-(2-HYDROXY-2-PHENYLETHYL)-2-ISOPROPYL-5,5-DIMETHYLCYCLOHEXANE-1-CARBOXAMIDE

SMILES

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

InChI

InChIKey=ILXQRAXCLBJOAD-DVKDBIPTSA-N
InChI=1S/C20H31NO2/c1-14(2)16-10-11-20(3,4)12-17(16)19(23)21-13-18(22)15-8-6-5-7-9-15/h5-9,14,16-18,22H,10-13H2,1-4H3,(H,21,23)/t16-,17+,18?/m1/s1

HIDE SMILES / InChI

Molecular Formula C20H31NO2
Molecular Weight 317.4656
Charge 0
Count
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 2 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 14:39:34 GMT 2023
Edited
by admin
on Sat Dec 16 14:39:34 GMT 2023
Record UNII
0JE81YYV52
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-(2-HYDROXY-2-PHENYLETHYL)-2-ISOPROPYL-5,5-DIMETHYLCYCLOHEXANE-1-CARBOXAMIDE
Systematic Name English
CYCLOHEXANECARBOXAMIDE, N-((2S)-2-HYDROXY-2-PHENYLETHYL)-5,5-DIMETHYL-2-(1-METHYLETHYL)-
Systematic Name English
CYCLOHEXANECARBOXAMIDE, N-((2R)-2-HYDROXY-2-PHENYLETHYL)-5,5-DIMETHYL-2-(1-METHYLETHYL)-
Systematic Name English
FEMA NO. 4896
Code English
Code System Code Type Description
CAS
2186611-08-3
Created by admin on Sat Dec 16 14:39:34 GMT 2023 , Edited by admin on Sat Dec 16 14:39:34 GMT 2023
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FDA UNII
0JE81YYV52
Created by admin on Sat Dec 16 14:39:34 GMT 2023 , Edited by admin on Sat Dec 16 14:39:34 GMT 2023
PRIMARY
PUBCHEM
146048069
Created by admin on Sat Dec 16 14:39:34 GMT 2023 , Edited by admin on Sat Dec 16 14:39:34 GMT 2023
PRIMARY