U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C12H12N2O2
Molecular Weight 216.2359
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DESETHYL-ETOMIDATE, (S)-

SMILES

C[C@H](N1C=NC=C1C(O)=O)C2=CC=CC=C2

InChI

InChIKey=RGYCCBLTSWHXIS-VIFPVBQESA-N
InChI=1S/C12H12N2O2/c1-9(10-5-3-2-4-6-10)14-8-13-7-11(14)12(15)16/h2-9H,1H3,(H,15,16)/t9-/m0/s1

HIDE SMILES / InChI

Molecular Formula C12H12N2O2
Molecular Weight 216.2359
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 07:51:18 GMT 2023
Edited
by admin
on Sat Dec 16 07:51:18 GMT 2023
Record UNII
NNC4DVY1A7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DESETHYL-ETOMIDATE, (S)-
Common Name English
(S)-DESETHYL-ETOMIDATE
Common Name English
1H-IMIDAZOLE-5-CARBOXYLIC ACID, 1-(1-PHENYLETHYL)-, (S)-
Common Name English
1H-IMIDAZOLE-5-CARBOXYLIC ACID, 1-((1S)-1-PHENYLETHYL)-
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID80205218
Created by admin on Sat Dec 16 07:51:18 GMT 2023 , Edited by admin on Sat Dec 16 07:51:18 GMT 2023
PRIMARY
FDA UNII
NNC4DVY1A7
Created by admin on Sat Dec 16 07:51:18 GMT 2023 , Edited by admin on Sat Dec 16 07:51:18 GMT 2023
PRIMARY
PUBCHEM
759853
Created by admin on Sat Dec 16 07:51:18 GMT 2023 , Edited by admin on Sat Dec 16 07:51:18 GMT 2023
PRIMARY
CAS
56649-49-1
Created by admin on Sat Dec 16 07:51:18 GMT 2023 , Edited by admin on Sat Dec 16 07:51:18 GMT 2023
PRIMARY