4-{1-[((E)-but-2-enyl)oxy]ethyl}-6-(2-methoxyphenyl)-2,2-dimethyl-2H-quinoline-1-carboxylic acid tert-butyl ester

HCID 20760331
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Basic information

Standard SMILES
C/C=C/COC(C)C1=CC(C)(C)N(C(=O)OC(C)(C)C)c2ccc(-c3ccccc3OC)cc21
InChIKey
WURADVZUWDHSLN-MDZDMXLPSA-N
Molecular formula
C29H37NO4
Average molar mass
463.6 g/mol

Names & identifiers

Preferred name
4-{1-[((E)-but-2-enyl)oxy]ethyl}-6-(2-methoxyphenyl)-2,2-dimethyl-2H-quinoline-1-carboxylic acid tert-butyl ester
IUPAC
tert-butyl 4-[1-[(E)-but-2-enoxy]ethyl]-6-(2-methoxyphenyl)-2,2-dimethylquinoline-1-carboxylate

Names & synonyms

SCHEMBL4702893WURADVZUWDHSLN-MDZDMXLPSA-N4-{1-[((E)-but-2-enyl)oxy]ethyl}-6-(2-methoxyphenyl)-2,2-dimethyl-2H-quinoline-1-carboxylic acid tert-butyl ester

Database identifiers

PubChem CID
20760331

Properties

Computed structural properties

XLogP
5.7
Topological polar surface area
48 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
8
Heavy atoms
34

Related reactions

2 records
New reaction record

Linked notes

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