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Details

Stereochemistry ACHIRAL
Molecular Formula C19H23NO3
Molecular Weight 313.3908
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SB-200473

SMILES

COC1=C(OC2CCCC2)C=C(C=C1)C3(CCC(=O)CC3)C#N

InChI

InChIKey=URXUAYQZIDJXGT-UHFFFAOYSA-N
InChI=1S/C19H23NO3/c1-22-17-7-6-14(12-18(17)23-16-4-2-3-5-16)19(13-20)10-8-15(21)9-11-19/h6-7,12,16H,2-5,8-11H2,1H3

HIDE SMILES / InChI

Molecular Formula C19H23NO3
Molecular Weight 313.3908
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 Fri Dec 15 15:56:54 GMT 2023
Edited
by admin
on Fri Dec 15 15:56:54 GMT 2023
Record UNII
QN1VGX3BLL
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SB-200473
Code English
CYCLOHEXANECARBONITRILE, 1-(3-(CYCLOPENTYLOXY)-4-METHOXYPHENYL)-4-OXO-
Systematic Name English
4-CYANO-4-(3-(CYCLOPENTYLOXY)-4-METHOXYPHENYL)CYCLOHEXAN-1-ONE
Systematic Name English
Code System Code Type Description
CAS
152630-47-2
Created by admin on Fri Dec 15 15:56:54 GMT 2023 , Edited by admin on Fri Dec 15 15:56:54 GMT 2023
PRIMARY
EPA CompTox
DTXSID70432031
Created by admin on Fri Dec 15 15:56:54 GMT 2023 , Edited by admin on Fri Dec 15 15:56:54 GMT 2023
PRIMARY
FDA UNII
QN1VGX3BLL
Created by admin on Fri Dec 15 15:56:54 GMT 2023 , Edited by admin on Fri Dec 15 15:56:54 GMT 2023
PRIMARY
PUBCHEM
9861604
Created by admin on Fri Dec 15 15:56:54 GMT 2023 , Edited by admin on Fri Dec 15 15:56:54 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY