Basic information
- CAS
55232-85-4- Standard SMILES
O=CNc1cc(C(=O)O)cc(OCc2ccccc2)c1C(=O)c1ccccc1- InChIKey
XALFVJMRRACEBT-UHFFFAOYSA-N- Molecular formula
- C22H17NO5
- Average molar mass
- 375.4 g/mol
- Monoisotopic mass
- 375.11067264
Names & identifiers
- Preferred name
- 4-Benzoyl-3-(benzyloxy)-5-formamidobenzoic acid
- IUPAC
- 4-benzoyl-3-formamido-5-phenylmethoxybenzoic acid
Names & synonyms
55232-85-44-Benzoyl-3-(benzyloxy)-5-formamidobenzoic acidCHEMBL3276875DTXSID70496936
Database identifiers
- CAS
55232-85-4- PubChem CID
- 12409656
- DTXSID
DTXSID70496936- ChEMBL
CHEMBL3276875
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 92.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 539
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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