[2-Acetyloxy-5-[2-[benzyl(tert-butyl)amino]acetyl]phenyl]methyl acetate;hydrochloride

HCID 178535717CAS 27475-27-0
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Basic information

Standard SMILES
CC(=O)OCc1cc(C(=O)CN(Cc2ccccc2)C(C)(C)C)ccc1OC(C)=O.Cl
InChIKey
IKOMJDAFAAYJJI-UHFFFAOYSA-N
Molecular formula
C24H30ClNO5
Average molar mass
447.9 g/mol

Names & identifiers

Preferred name
[2-Acetyloxy-5-[2-[benzyl(tert-butyl)amino]acetyl]phenyl]methyl acetate;hydrochloride
IUPAC
[2-acetyloxy-5-[2-[benzyl(tert-butyl)amino]acetyl]phenyl]methyl acetate;hydrochloride
English name
4-Acetyloxy-3-acetyloxymethyl-(N-benzyl-N-tertbutylamino)acetophenone hydrochloride
Molecular formula
C24H29NO5.ClH
Molecular weight
447.95

Names & synonyms

SCHEMBL281175474-Acetyloxy-3-acetyloxymethyl-(N-benzyl-N-tertbutylamino)acetophenone hydrochloride

Database identifiers

CAS
27475-27-0

Properties

Computed structural properties

Topological polar surface area
72.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
11
Heavy atoms
31

Chemistry & industry

Upstream & downstream products

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