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Details

Stereochemistry ABSOLUTE
Molecular Formula C14H21NO
Molecular Weight 219.3226
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-ETHYLHEXEDRONE, (S)-

SMILES

CCCC[C@H](NCC)C(=O)C1=CC=CC=C1

InChI

InChIKey=CWNKMHIETKEBCA-ZDUSSCGKSA-N
InChI=1S/C14H21NO/c1-3-5-11-13(15-4-2)14(16)12-9-7-6-8-10-12/h6-10,13,15H,3-5,11H2,1-2H3/t13-/m0/s1

HIDE SMILES / InChI

Molecular Formula C14H21NO
Molecular Weight 219.3226
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 15:33:42 UTC 2023
Edited
by admin
on Sat Dec 16 15:33:42 UTC 2023
Record UNII
NI6YO4P5NI
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-ETHYLHEXEDRONE, (S)-
Common Name English
2-(ETHYLAMINO)-1-PHENYLHEXAN-1-ONE, (S)-
Systematic Name English
(S)-N-ETHYL-HEXEDRONE
Common Name English
1-HEXANONE, 2-(ETHYLAMINO)-1-PHENYL-, (2S)-
Systematic Name English
Code System Code Type Description
PUBCHEM
129415760
Created by admin on Sat Dec 16 15:33:42 UTC 2023 , Edited by admin on Sat Dec 16 15:33:42 UTC 2023
PRIMARY
CAS
2304915-57-7
Created by admin on Sat Dec 16 15:33:42 UTC 2023 , Edited by admin on Sat Dec 16 15:33:42 UTC 2023
PRIMARY
FDA UNII
NI6YO4P5NI
Created by admin on Sat Dec 16 15:33:42 UTC 2023 , Edited by admin on Sat Dec 16 15:33:42 UTC 2023
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER