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(2-methoxyethyl) 1-(1,2,3,4-tetrahydro-1-naphthalenyl)-1H-imidazole-5-carboxylate

HCID 53765766
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
COCCOC(=O)c1cncn1C1CCCc2ccccc21
InChIKey
DLDOZTMOJUPCQI-UHFFFAOYSA-N
Molecular formula
C17H20N2O3
Average molar mass
300.35 g/mol

Names & identifiers

Preferred name
(2-methoxyethyl) 1-(1,2,3,4-tetrahydro-1-naphthalenyl)-1H-imidazole-5-carboxylate
IUPAC
2-methoxyethyl 3-(1,2,3,4-tetrahydronaphthalen-1-yl)imidazole-4-carboxylate

Names & synonyms

SCHEMBL9496305DLDOZTMOJUPCQI-UHFFFAOYSA-N(2-methoxyethyl) 1-(1,2,3,4-tetrahydro-1-naphthalenyl)-1H-imidazole-5-carboxylate

Database identifiers

PubChem CID
53765766

Properties

Computed structural properties

XLogP
2.4
Topological polar surface area
53.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
6
Heavy atoms
22
Formal charge
0
Complexity
377

Related reactions

2 records
New reaction record
HRID 5783 reaction equation
HRID 5783As productuspto-grants-1993_09
HRID 2333814 reaction equation
HRID 2333814As productTraining data from https://doi.org/10.1039/C8SC04228D (10/10)

Compound notes

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