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Details

Stereochemistry MIXED
Molecular Formula C18H20O2
Molecular Weight 268.3502
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-(6-METHOXYNAPHTHALEN-2-YL)-5-METHYLCYCLOHEXANONE

SMILES

COC1=CC2=CC=C(C=C2C=C1)C3CC(C)CC(=O)C3

InChI

InChIKey=JAQDUSAFXSHFAH-UHFFFAOYSA-N
InChI=1S/C18H20O2/c1-12-7-16(10-17(19)8-12)14-3-4-15-11-18(20-2)6-5-13(15)9-14/h3-6,9,11-12,16H,7-8,10H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C18H20O2
Molecular Weight 268.3502
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 Thu Jul 06 14:04:13 UTC 2023
Edited
by admin
on Thu Jul 06 14:04:13 UTC 2023
Record UNII
X222BJ8VUU
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-(6-METHOXYNAPHTHALEN-2-YL)-5-METHYLCYCLOHEXANONE
Systematic Name English
NABUMETONE IMPURITY A [EP IMPURITY]
Common Name English
5-(6'-METHOXY-2'-NAPHTHYL)-3-METHYLCYCLOHEXAN-1-ONE
Systematic Name English
CYCLOHEXANONE, 3-(6-METHOXY-2-NAPHTHALENYL)-5-METHYL-
Systematic Name English
NABUMETONE IMPURITY, 5-(6'-METHOXY-2'-NAPHTHYL)-3-METHYLCYCLOHEXAN-1-ONE- [USP IMPURITY]
Common Name English
Code System Code Type Description
PUBCHEM
72941805
Created by admin on Thu Jul 06 14:04:13 UTC 2023 , Edited by admin on Thu Jul 06 14:04:13 UTC 2023
PRIMARY
CAS
343272-52-6
Created by admin on Thu Jul 06 14:04:13 UTC 2023 , Edited by admin on Thu Jul 06 14:04:13 UTC 2023
PRIMARY
FDA UNII
X222BJ8VUU
Created by admin on Thu Jul 06 14:04:13 UTC 2023 , Edited by admin on Thu Jul 06 14:04:13 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP