Basic information
- Standard SMILES
COC(=O)C(=CNc1ccccc1)C(=O)c1ccc(C)c(C)c1- InChIKey
ZEROTNHAZJZWNT-UHFFFAOYSA-N- Molecular formula
- C19H19NO3
- Average molar mass
- 309.4 g/mol
- Monoisotopic mass
- 309.13649347
Names & identifiers
- IUPAC
- methyl 3-anilino-2-(3,4-dimethylbenzoyl)prop-2-enoate
Database identifiers
- PubChem CID
- 66879316
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 55.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 452
Related reactions
3 records
Compound notes
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