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Compound
[2-[(2-Ethylphenyl)carbamoyl]phenyl] acetate
HCID
3364610
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Basic information
Standard SMILES
CCc1ccccc1NC(=O)c1ccccc1OC(C)=O
InChIKey
PJBXEVTXDWWRGD-UHFFFAOYSA-N
Molecular formula
C17H17NO3
Average molar mass
283.32 g/mol
Names & identifiers
Preferred name
[2-[(2-Ethylphenyl)carbamoyl]phenyl] acetate
IUPAC
[2-[(2-ethylphenyl)carbamoyl]phenyl] acetate
Names & synonyms
Oprea1_057628
SCHEMBL167923
Database identifiers
PubChem CID
3364610
Properties
Computed structural properties
XLogP
3.3
Topological polar surface area
55.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
5
Heavy atoms
21
Formal charge
0
Complexity
369
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Related reactions
1 records
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As solvent
HRID
153380
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Compound notes
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