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Details

Stereochemistry ACHIRAL
Molecular Formula C30H22O2
Molecular Weight 414.4945
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-(4-METHOXYPHENYL)-2,4,5-TRIPHENYL-2,4-CYCLOPENTADIEN-1-ONE

SMILES

COC1=CC=C(C=C1)C2=C(C(=O)C(=C2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChIKey=MRIYNLXCRJKRPA-UHFFFAOYSA-N
InChI=1S/C30H22O2/c1-32-25-19-17-24(18-20-25)27-26(21-11-5-2-6-12-21)28(22-13-7-3-8-14-22)30(31)29(27)23-15-9-4-10-16-23/h2-20H,1H3

HIDE SMILES / InChI

Molecular Formula C30H22O2
Molecular Weight 414.4945
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 Sat Dec 16 12:45:30 GMT 2023
Edited
by admin
on Sat Dec 16 12:45:30 GMT 2023
Record UNII
Z62G7OX9J7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-(4-METHOXYPHENYL)-2,4,5-TRIPHENYL-2,4-CYCLOPENTADIEN-1-ONE
Systematic Name English
NSC-75898
Code English
2,4-CYCLOPENTADIEN-1-ONE, 3-(4-METHOXYPHENYL)-2,4,5-TRIPHENYL-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID10215885
Created by admin on Sat Dec 16 12:45:30 GMT 2023 , Edited by admin on Sat Dec 16 12:45:30 GMT 2023
PRIMARY
CAS
65648-91-1
Created by admin on Sat Dec 16 12:45:30 GMT 2023 , Edited by admin on Sat Dec 16 12:45:30 GMT 2023
PRIMARY
PUBCHEM
253240
Created by admin on Sat Dec 16 12:45:30 GMT 2023 , Edited by admin on Sat Dec 16 12:45:30 GMT 2023
PRIMARY
NSC
75898
Created by admin on Sat Dec 16 12:45:30 GMT 2023 , Edited by admin on Sat Dec 16 12:45:30 GMT 2023
PRIMARY
FDA UNII
Z62G7OX9J7
Created by admin on Sat Dec 16 12:45:30 GMT 2023 , Edited by admin on Sat Dec 16 12:45:30 GMT 2023
PRIMARY