Basic information
- Standard SMILES
C=CCOc1cccc(CC(NC(=O)OC(C)(C)C)C(=O)OC)c1- InChIKey
XOGRADJXDSOREU-UHFFFAOYSA-N- Molecular formula
- C18H25NO5
- Average molar mass
- 335.4 g/mol
Names & identifiers
- Preferred name
- Methyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(3-prop-2-enoxyphenyl)propanoate
- IUPAC
- methyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(3-prop-2-enoxyphenyl)propanoate
Names & synonyms
SCHEMBL2353544
Database identifiers
- PubChem CID
- 67375232
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 73.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 10
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 430
Related reactions
2 records
Compound notes
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