Basic information
- Standard SMILES
CCCCC1Oc2cc(C(=O)OC)ccc2N(C(C)C)C1=O- InChIKey
OVQMVRIPPFECIQ-UHFFFAOYSA-N- Molecular formula
- C17H23NO4
- Average molar mass
- 305.4 g/mol
Names & identifiers
- Preferred name
- 2-butyl-7-methoxycarbonyl-4-(2-propyl)-3-oxo-3,4-dihydro-2H-1,4-benzoxazine
- IUPAC
- methyl 2-butyl-3-oxo-4-propan-2-yl-1,4-benzoxazine-7-carboxylate
Names & synonyms
SCHEMBL8039892OVQMVRIPPFECIQ-UHFFFAOYSA-N2-butyl-7-methoxycarbonyl-4-(2-propyl)-3-oxo-3,4-dihydro-2H-1,4-benzoxazine
Database identifiers
- PubChem CID
- 10686018
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 55.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 409
Related reactions
1 records
Compound notes
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