Basic information
- Standard SMILES
O=C(c1ccccc1)c1ccc(NC(=O)N2CCC3(CC2)OC(=O)c2ccccc23)cc1- InChIKey
OXNBPGQSMNSDJW-UHFFFAOYSA-N- Molecular formula
- C26H22N2O4
- Average molar mass
- 426.5 g/mol
Names & identifiers
- Preferred name
- N-(4-benzoylphenyl)-3-oxospiro[isobenzofuran-1(3H),4'-piperidine]-1'-carboxamide
- IUPAC
- N-(4-benzoylphenyl)-3-oxospiro[2-benzofuran-1,4'-piperidine]-1'-carboxamide
Names & synonyms
SCHEMBL5425030OXNBPGQSMNSDJW-UHFFFAOYSA-NN-(4-benzoylphenyl)-3-oxospiro[isobenzofuran-1(3H), 4'-piperidine]-1'-carboxamideN-(4-benzoylphenyl)-3-oxospiro[isobenzofuran-1(3H),4'-piperidine]-1'-carboxamideN-(4-benzoylphenyl)-3-oxospiro[isobenzofuran-1(3H),4'-piperidine]-1'carboxamide
Database identifiers
- PubChem CID
- 9845361
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 75.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 715
Related reactions
8 records
Compound notes
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