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1-(2-acetoxy-2-methylpropyl)-1H-imidazo[4,5-c]quinolin-5-oxide

HCID 20183585
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Basic information

Standard SMILES
CC(=O)OC(C)(C)Cn1cnc2c[n+]([O-])c3ccccc3c21
InChIKey
JHYYSNBCFKXTPS-UHFFFAOYSA-N
Molecular formula
C16H17N3O3
Average molar mass
299.32 g/mol

Names & identifiers

Preferred name
1-(2-acetoxy-2-methylpropyl)-1H-imidazo[4,5-c]quinolin-5-oxide
IUPAC
[2-methyl-1-(5-oxidoimidazo[4,5-c]quinolin-5-ium-1-yl)propan-2-yl] acetate

Names & synonyms

SCHEMBL10731238JHYYSNBCFKXTPS-UHFFFAOYSA-N1-(2-acetoxy-2-methylpropyl)-1H-imidazo[4,5-c]quinolin-5-oxide

Database identifiers

PubChem CID
20183585

Properties

Computed structural properties

XLogP
1.2
Topological polar surface area
69.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
22
Formal charge
0
Complexity
429

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Related reactions

1 records
New reaction record
HRID 255563 reaction equation
HRID 255563As reactantuspto-grants-1987_10

Compound notes

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