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Details

Stereochemistry ACHIRAL
Molecular Formula C47H40O4
Molecular Weight 668.8181
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 4
Charge 0

SHOW SMILES / InChI
Structure of 2-(1,5-Bis(2-(benzyloxy)phenyl)-5-(2-methoxy-5-methylphenyl)-1,2,3,4-pentatetraenyl)-1-methoxy-4-methylbenzene

SMILES

COC1=C(C=C(C)C=C1)C(=C=C=C=C(C2=C(OCC3=CC=CC=C3)C=CC=C2)C4=C(OC)C=CC(C)=C4)C5=C(OCC6=CC=CC=C6)C=CC=C5

InChI

InChIKey=UTAKUKSYIZOHNP-UHFFFAOYSA-N
InChI=1S/C47H40O4/c1-34-26-28-44(48-3)42(30-34)38(40-20-11-13-24-46(40)50-32-36-16-7-5-8-17-36)22-15-23-39(43-31-35(2)27-29-45(43)49-4)41-21-12-14-25-47(41)51-33-37-18-9-6-10-19-37/h5-14,16-21,24-31H,32-33H2,1-4H3

HIDE SMILES / InChI

Molecular Formula C47H40O4
Molecular Weight 668.8181
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 4
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 20:39:19 GMT 2025
Edited
by admin
on Tue Apr 01 20:39:19 GMT 2025
Record UNII
Z3NK9TPH9Q
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-302072
Preferred Name English
2-(1,5-Bis(2-(benzyloxy)phenyl)-5-(2-methoxy-5-methylphenyl)-1,2,3,4-pentatetraenyl)-1-methoxy-4-methylbenzene
Systematic Name English
1,1?-[1,5-Bis(2-methoxy-5-methylphenyl)-1,2,3,4-pentatetraene-1,5-diyl]bis[2-(phenylmethoxy)benzene]
Systematic Name English
Benzene, 1,1?-[1,5-bis(2-methoxy-5-methylphenyl)-1,2,3,4-pentatetraene-1,5-diyl]bis[2-(phenylmethoxy)-
Systematic Name English
Code System Code Type Description
PUBCHEM
327361
Created by admin on Tue Apr 01 20:39:19 GMT 2025 , Edited by admin on Tue Apr 01 20:39:19 GMT 2025
PRIMARY
EPA CompTox
DTXSID90214538
Created by admin on Tue Apr 01 20:39:19 GMT 2025 , Edited by admin on Tue Apr 01 20:39:19 GMT 2025
PRIMARY
NSC
302072
Created by admin on Tue Apr 01 20:39:19 GMT 2025 , Edited by admin on Tue Apr 01 20:39:19 GMT 2025
PRIMARY
CAS
64323-22-4
Created by admin on Tue Apr 01 20:39:19 GMT 2025 , Edited by admin on Tue Apr 01 20:39:19 GMT 2025
PRIMARY
FDA UNII
Z3NK9TPH9Q
Created by admin on Tue Apr 01 20:39:19 GMT 2025 , Edited by admin on Tue Apr 01 20:39:19 GMT 2025
PRIMARY