Basic information
- Standard SMILES
O=C(Nc1ccc(/C=N/OCc2ccccc2)cc1)N1Cc2ccccc2C1- InChIKey
SBBALKJCLXMYGZ-ZVHZXABRSA-N- Molecular formula
- C23H21N3O2
- Average molar mass
- 371.4 g/mol
Names & identifiers
- Preferred name
- N-[4-[(E)-phenylmethoxyiminomethyl]phenyl]-1,3-dihydroisoindole-2-carboxamide
- IUPAC
- N-[4-[(E)-phenylmethoxyiminomethyl]phenyl]-1,3-dihydroisoindole-2-carboxamide
Names & synonyms
SCHEMBL3704297CHEMBL3930904BDBM217155US9302989, 566
Database identifiers
- PubChem CID
- 57510176
- ChEMBL
CHEMBL3930904
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 53.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 510
Related reactions
1 records
Compound notes
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