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Details

Stereochemistry ACHIRAL
Molecular Formula C17H12O4
Molecular Weight 280.2748
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (4-OXO-3-PHENYL-4H-CHROMEN-8-YL)ACETIC ACID

SMILES

OC(=O)CC1=C2OC=C(C(=O)C2=CC=C1)C3=CC=CC=C3

InChI

InChIKey=FMQFDPXKSNAJLI-UHFFFAOYSA-N
InChI=1S/C17H12O4/c18-15(19)9-12-7-4-8-13-16(20)14(10-21-17(12)13)11-5-2-1-3-6-11/h1-8,10H,9H2,(H,18,19)

HIDE SMILES / InChI

Molecular Formula C17H12O4
Molecular Weight 280.2748
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 12:42:19 GMT 2023
Edited
by admin
on Sat Dec 16 12:42:19 GMT 2023
Record UNII
8PI064IZ06
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(4-OXO-3-PHENYL-4H-CHROMEN-8-YL)ACETIC ACID
Systematic Name English
NSC-361584
Code English
4-OXO-3-PHENYL-4H-1-BENZOPYRAN-8-ACETIC ACID
Systematic Name English
4H-1-BENZOPYRAN-8-ACETIC ACID, 4-OXO-3-PHENYL-
Systematic Name English
Code System Code Type Description
FDA UNII
8PI064IZ06
Created by admin on Sat Dec 16 12:42:19 GMT 2023 , Edited by admin on Sat Dec 16 12:42:19 GMT 2023
PRIMARY
CAS
87627-17-6
Created by admin on Sat Dec 16 12:42:19 GMT 2023 , Edited by admin on Sat Dec 16 12:42:19 GMT 2023
PRIMARY
PUBCHEM
338523
Created by admin on Sat Dec 16 12:42:19 GMT 2023 , Edited by admin on Sat Dec 16 12:42:19 GMT 2023
PRIMARY
EPA CompTox
DTXSID70236536
Created by admin on Sat Dec 16 12:42:19 GMT 2023 , Edited by admin on Sat Dec 16 12:42:19 GMT 2023
PRIMARY
NSC
361584
Created by admin on Sat Dec 16 12:42:19 GMT 2023 , Edited by admin on Sat Dec 16 12:42:19 GMT 2023
PRIMARY