Basic information
- Standard SMILES
CC(NC(=O)c1ccc2c(c1)OCCO2)c1cccc2ccccc12- InChIKey
QKXGYOKRDUPHDO-UHFFFAOYSA-N- Molecular formula
- C21H19NO3
- Average molar mass
- 333.4 g/mol
- Monoisotopic mass
- 333.13649347
Names & identifiers
- Preferred name
- N-(1-naphthalen-1-ylethyl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide
- IUPAC
- N-(1-naphthalen-1-ylethyl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide
Names & synonyms
AKOS008502978
Database identifiers
- PubChem CID
- 45752149
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 47.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 468
Related reactions
93 records
Compound notes
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