Basic information
- Standard SMILES
C=CCOC(=O)NC(CC(=O)OCC)c1cccc(N)c1- InChIKey
WDOATZZSMBNCPE-UHFFFAOYSA-N- Molecular formula
- C15H20N2O4
- Average molar mass
- 292.33 g/mol
Names & identifiers
- Preferred name
- Ethyl 3-allyloxycarbonylamino-3-(3-aminophenyl)-propionate
- IUPAC
- ethyl 3-(3-aminophenyl)-3-(prop-2-enoxycarbonylamino)propanoate
Names & synonyms
SCHEMBL3813191WDOATZZSMBNCPE-UHFFFAOYSA-NEthyl 3-allyloxycarbonylamino-3-(3-aminophenyl)-propionateEthyl 3-{[(allyloxy)-carbonyl]-amino}-3-(3-aminophenyl)-propanoateEthyl 3-{[(allyloxy)carbonyl]amino}-3-(3-aminophenyl)propanoate
Database identifiers
- PubChem CID
- 21101501
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 90.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 360
Related reactions
6 records
Compound notes
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