Basic information
- Standard SMILES
CN1C(=O)COc2cc3c(cc21)CCN(C(=O)OC(C)(C)C)CC3- InChIKey
WCTRSMLDDPIMQY-UHFFFAOYSA-N- Molecular formula
- C18H24N2O4
- Average molar mass
- 332.4 g/mol
- Monoisotopic mass
- 332.17360725
Names & identifiers
- Preferred name
- 1,1-Dimethylethyl 4-methyl-3-oxo-3,4,6,7,9,10-hexahydro[1,4]oxazino[2,3-h][3]benzazepine-8(2H)-carboxylate
- IUPAC
- tert-butyl 4-methyl-3-oxo-6,7,9,10-tetrahydro-[1,4]oxazino[2,3-h][3]benzazepine-8-carboxylate
Names & synonyms
SCHEMBL2310242WCTRSMLDDPIMQY-UHFFFAOYSA-N1,1-Dimethylethyl 4-methyl-3-oxo-3,4,6,7,9,10-hexahydro[1,4]oxazino[2,3-h][3]benzazepine-8(2H)-carboxylate
Database identifiers
- PubChem CID
- 58494792
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 59.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 502
Related reactions
2 records
Compound notes
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