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[5-[1-(tert-butyldimethylsilyloxy)ethyl]-6-methoxynaphthalen-2-yl]-(1-trityl-1H-imidazol-4-yl)ketone

HCID 22018331
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
COc1ccc2cc(C(=O)c3cn(C(c4ccccc4)(c4ccccc4)c4ccccc4)cn3)ccc2c1C(C)O[Si](C)(C)C(C)(C)C
InChIKey
ZQYIGTMFBGSDDW-UHFFFAOYSA-N
Molecular formula
C42H44N2O3Si
Average molar mass
652.9 g/mol
Monoisotopic mass
652.3121198

Names & identifiers

Preferred name
[5-[1-(tert-butyldimethylsilyloxy)ethyl]-6-methoxynaphthalen-2-yl]-(1-trityl-1H-imidazol-4-yl)ketone
IUPAC
[5-[1-[tert-butyl(dimethyl)silyl]oxyethyl]-6-methoxynaphthalen-2-yl]-(1-tritylimidazol-4-yl)methanone

Names & synonyms

SCHEMBL5751865ZQYIGTMFBGSDDW-UHFFFAOYSA-N[5-[1-(tert-butyldimethylsilyloxy)ethyl]-6-methoxynaphthalen-2-yl]-(1-trityl-1H-imidazol-4-yl)ketone

Database identifiers

PubChem CID
22018331

Properties

Computed structural properties

Topological polar surface area
53.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
11
Heavy atoms
48
Formal charge
0
Complexity
994

Related reactions

3 records
New reaction record
HRID 701741 reaction equation
HRID 701741As reactantTraining data from https://doi.org/10.1039/C8SC04228D (3/10)
HRID 1116691 reaction equation
HRID 1116691As reactantTraining data from https://doi.org/10.1039/C8SC04228D (7/10)
HRID 1368531 reaction equation
HRID 1368531As reactantuspto-grants-2003_06

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes