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Details

Stereochemistry ACHIRAL
Molecular Formula C12H18N2O4
Molecular Weight 254.2823
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ETHYL 6-(5-METHYL-2-OXO-1,3-DIHYDROIMIDAZOL-4-YL)-6-OXOHEXANOATE

SMILES

CCOC(=O)CCCCC(=O)C1=C(C)NC(=O)N1

InChI

InChIKey=QKLTUZKTQSIWKO-UHFFFAOYSA-N
InChI=1S/C12H18N2O4/c1-3-18-10(16)7-5-4-6-9(15)11-8(2)13-12(17)14-11/h3-7H2,1-2H3,(H2,13,14,17)

HIDE SMILES / InChI

Molecular Formula C12H18N2O4
Molecular Weight 254.2823
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 19:29:01 GMT 2025
Edited
by admin
on Tue Apr 01 19:29:01 GMT 2025
Record UNII
NLG753K1UI
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ETHYL 2,3-DIHYDRO-5-METHYL-EPSILON-2-DIOXO-1H-IMIDAZOLE-4-HEXANOATE
Preferred Name English
ETHYL 6-(5-METHYL-2-OXO-1,3-DIHYDROIMIDAZOL-4-YL)-6-OXOHEXANOATE
Systematic Name English
.ALPHA.-OXODEHYDRODESTHIOBIOTIN
Common Name English
1H-IMIDAZOLE-4-HEXANOIC ACID, 2,3-DIHYDRO-5-METHYL-.EPSILON.,2-DIOXO-, ETHYL ESTER
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID20192471
Created by admin on Tue Apr 01 19:29:01 GMT 2025 , Edited by admin on Tue Apr 01 19:29:01 GMT 2025
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PUBCHEM
2166009
Created by admin on Tue Apr 01 19:29:01 GMT 2025 , Edited by admin on Tue Apr 01 19:29:01 GMT 2025
PRIMARY
ECHA (EC/EINECS)
254-359-5
Created by admin on Tue Apr 01 19:29:01 GMT 2025 , Edited by admin on Tue Apr 01 19:29:01 GMT 2025
PRIMARY
FDA UNII
NLG753K1UI
Created by admin on Tue Apr 01 19:29:01 GMT 2025 , Edited by admin on Tue Apr 01 19:29:01 GMT 2025
PRIMARY
CAS
39215-52-6
Created by admin on Tue Apr 01 19:29:01 GMT 2025 , Edited by admin on Tue Apr 01 19:29:01 GMT 2025
PRIMARY