(Z)-5-fluoro-2-methyl-1-(3,4,5-trimethoxybenzylidene)-3-indenylacetic acid

HCID 9864863

Basic information

Standard SMILES
COc1cc(/C=C2/C(C)=C(CC(=O)O)c3cc(F)ccc32)cc(OC)c1OC
InChIKey
IBDWMGKPYYUXKJ-APSNUPSMSA-N
Molecular formula
C22H21FO5
Average molar mass
384.4 g/mol

Names & identifiers

Preferred name
(Z)-5-fluoro-2-methyl-1-(3,4,5-trimethoxybenzylidene)-3-indenylacetic acid
IUPAC
2-[(3Z)-6-fluoro-2-methyl-3-[(3,4,5-trimethoxyphenyl)methylidene]inden-1-yl]acetic acid

Names & synonyms

SCHEMBL6936351IBDWMGKPYYUXKJ-APSNUPSMSA-N(Z)-5-fluoro-2-methyl-1-(3,4,5-trimethoxybenzylidene)-3-indenylaceticacid(Z)-5-fluoro-2-methyl-1-(3,4,5-trimethoxybenzylidene)-3-indenyl-acetic acid(Z)-5-fluoro-2-methyl-1-(3,4,5-trimethoxybenzylidene)-3-indenylacetic acid

Database identifiers

PubChem CID
9864863
Nikkaji
J1.381.535F

Properties

Computed structural properties

XLogP
4.2
Topological polar surface area
65 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
6
Heavy atoms
28

Related reactions

8 records

Compound notes

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