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Methyl 2-[3-vinyl-4-(quinolin-2-yl-methoxy)phenyl]acetate

HCID 19087790
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
C=Cc1cc(CC(=O)OC)ccc1OCc1ccc2ccccc2n1
InChIKey
SWKBYGNQMXFJQR-UHFFFAOYSA-N
Molecular formula
C21H19NO3
Average molar mass
333.4 g/mol

Names & identifiers

Preferred name
Methyl 2-[3-vinyl-4-(quinolin-2-yl-methoxy)phenyl]acetate
IUPAC
methyl 2-[3-ethenyl-4-(quinolin-2-ylmethoxy)phenyl]acetate

Names & synonyms

SCHEMBL9430847SWKBYGNQMXFJQR-UHFFFAOYSA-NMethyl 2-[3-vinyl-4-(quinolin-2-yl-methoxy)phenyl]acetate

Database identifiers

PubChem CID
19087790

Properties

Computed structural properties

XLogP
4.3
Topological polar surface area
48.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
7
Heavy atoms
25
Formal charge
0
Complexity
452

Related reactions

3 records
New reaction record
HRID 1464390 reaction equation
HRID 1464390As productuspto-grants-1994_04
HRID 1464391 reaction equation
HRID 1464391As reactantuspto-grants-1994_04
HRID 1464392 reaction equation
HRID 1464392As reactantuspto-grants-1994_04

Compound notes

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