N-tert-Butyl-2-oxo-7-propoxy-2H-1-benzopyran-3-carboxamide
Basic information
- CAS
7047-56-5- Standard SMILES
CCCOc1ccc2cc(C(=O)NC(C)(C)C)c(=O)oc2c1- InChIKey
JIOIMMJEKQOCGO-UHFFFAOYSA-N- Molecular formula
- C17H21NO4
- Average molar mass
- 303.35 g/mol
- Monoisotopic mass
- 303.14705815
Names & identifiers
- Preferred name
- N-tert-Butyl-2-oxo-7-propoxy-2H-1-benzopyran-3-carboxamide
- IUPAC
- N-tert-butyl-2-oxo-7-propoxychromene-3-carboxamide
Names & synonyms
7047-56-5DTXSID80414222N-tert-Butyl-2-oxo-7-propoxy-2H-1-benzopyran-3-carboxamideAKOS002731897
Database identifiers
- CAS
7047-56-5- PubChem CID
- 5263306
- DTXSID
DTXSID80414222
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 64.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 464
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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