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Details

Stereochemistry ACHIRAL
Molecular Formula C18H16O3
Molecular Weight 280.3178
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-(.GAMMA.-PHENYLPROPYL)-4-HYDROXYCOUMARIN

SMILES

OC1=C(CCCC2=CC=CC=C2)C(=O)OC3=CC=CC=C13

InChI

InChIKey=LJALTWSIISCMPZ-UHFFFAOYSA-N
InChI=1S/C18H16O3/c19-17-14-10-4-5-12-16(14)21-18(20)15(17)11-6-9-13-7-2-1-3-8-13/h1-5,7-8,10,12,19H,6,9,11H2

HIDE SMILES / InChI

Molecular Formula C18H16O3
Molecular Weight 280.3178
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 12:04:00 GMT 2023
Edited
by admin
on Sat Dec 16 12:04:00 GMT 2023
Record UNII
2IQA80G12B
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-(.GAMMA.-PHENYLPROPYL)-4-HYDROXYCOUMARIN
Systematic Name English
4-HYDROXY-3-(3-PHENYLPROPYL)-2H-1-BENZOPYRAN-2-ONE
Systematic Name English
COUMARIN, 4-HYDROXY-3-(3-PHENYLPROPYL)-
Systematic Name English
2H-1-BENZOPYRAN-2-ONE, 4-HYDROXY-3-(3-PHENYLPROPYL)-
Systematic Name English
Code System Code Type Description
FDA UNII
2IQA80G12B
Created by admin on Sat Dec 16 12:04:00 GMT 2023 , Edited by admin on Sat Dec 16 12:04:00 GMT 2023
PRIMARY
CAS
6431-08-9
Created by admin on Sat Dec 16 12:04:00 GMT 2023 , Edited by admin on Sat Dec 16 12:04:00 GMT 2023
PRIMARY
PUBCHEM
54711488
Created by admin on Sat Dec 16 12:04:00 GMT 2023 , Edited by admin on Sat Dec 16 12:04:00 GMT 2023
PRIMARY