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Details

Stereochemistry ACHIRAL
Molecular Formula C23H26INO3
Molecular Weight 491.3619
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (2-BUTYL-3-BENZOFURANYL)(4-(2-(ETHYLAMINO)ETHOXY)-3-IODOPHENYL)METHANONE

SMILES

CCCCC1=C(C(=O)C2=CC(I)=C(OCCNCC)C=C2)C3=C(O1)C=CC=C3

InChI

InChIKey=CFVCYTDXVQNGLP-UHFFFAOYSA-N
InChI=1S/C23H26INO3/c1-3-5-9-21-22(17-8-6-7-10-19(17)28-21)23(26)16-11-12-20(18(24)15-16)27-14-13-25-4-2/h6-8,10-12,15,25H,3-5,9,13-14H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C23H26INO3
Molecular Weight 491.3619
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Record UNII
EL6KZ5H96P
Record Status Validated (UNII)
Record Version