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Details

Stereochemistry MIXED
Molecular Formula C22H20O6
Molecular Weight 380.3906
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-(BENZOYLOXY)-3-((BENZOYLOXY)METHYL)-5-METHYLCYCLOHEXANE-1,2-DIONE

SMILES

CC1CC(=O)C(=O)C(COC(=O)C2=CC=CC=C2)(C1)OC(=O)C3=CC=CC=C3

InChI

InChIKey=NMIGCLQEJZPQGL-UHFFFAOYSA-N
InChI=1S/C22H20O6/c1-15-12-18(23)19(24)22(13-15,28-21(26)17-10-6-3-7-11-17)14-27-20(25)16-8-4-2-5-9-16/h2-11,15H,12-14H2,1H3

HIDE SMILES / InChI

Molecular Formula C22H20O6
Molecular Weight 380.3906
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:19:10 GMT 2023
Edited
by admin
on Sat Dec 16 11:19:10 GMT 2023
Record UNII
HY1617P61Q
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-(BENZOYLOXY)-3-((BENZOYLOXY)METHYL)-5-METHYLCYCLOHEXANE-1,2-DIONE
Systematic Name English
1,2-CYCLOHEXANEDIONE, 3-(BENZOYLOXY)-3-((BENZOYLOXY)METHYL)-5-METHYL-
Systematic Name English
Code System Code Type Description
FDA UNII
HY1617P61Q
Created by admin on Sat Dec 16 11:19:10 GMT 2023 , Edited by admin on Sat Dec 16 11:19:10 GMT 2023
PRIMARY
PUBCHEM
119057585
Created by admin on Sat Dec 16 11:19:10 GMT 2023 , Edited by admin on Sat Dec 16 11:19:10 GMT 2023
PRIMARY
CAS
90369-59-8
Created by admin on Sat Dec 16 11:19:10 GMT 2023 , Edited by admin on Sat Dec 16 11:19:10 GMT 2023
ALTERNATIVE
CAS
35802-10-9
Created by admin on Sat Dec 16 11:19:10 GMT 2023 , Edited by admin on Sat Dec 16 11:19:10 GMT 2023
PRIMARY