5-Cyano-5-(4-methoxy-dibenzofuran-1-yl)-2-oxo-cyclohexane carboxylic acid methyl ester

HCID 24755595
Substructure searchFind similar structures

Basic information

Standard SMILES
COC(=O)C1CC(C#N)(c2ccc(OC)c3oc4ccccc4c23)CCC1=O
InChIKey
HIGCNPFUSCKGDA-UHFFFAOYSA-N
Molecular formula
C22H19NO5
Average molar mass
377.4 g/mol

Names & identifiers

Preferred name
5-Cyano-5-(4-methoxy-dibenzofuran-1-yl)-2-oxo-cyclohexane carboxylic acid methyl ester
IUPAC
methyl 5-cyano-5-(4-methoxydibenzofuran-1-yl)-2-oxocyclohexane-1-carboxylate

Names & synonyms

SCHEMBL4012666HIGCNPFUSCKGDA-UHFFFAOYSA-N5-cyano-5-(4-methoxy-dibenzofuran-1-yl)-2-oxo-cyclohexane carboxylic acid methyl ester

Database identifiers

PubChem CID
24755595

Properties

Computed structural properties

XLogP
3.4
Topological polar surface area
89.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
4
Heavy atoms
28

Related reactions

7 records
New reaction record

Linked notes

Loading…