Basic information
- Standard SMILES
COC(=O)COc1cccc(CCNC(=O)/C=C/c2cccnc2)c1- InChIKey
AZUBNVGVLOFQAI-BQYQJAHWSA-N- Molecular formula
- C19H20N2O4
- Average molar mass
- 340.4 g/mol
Names & identifiers
- Preferred name
- methyl [3-[2-[(E)-3-(3-pyridyl)acryloylamino]ethyl]phenoxy]acetate
- IUPAC
- methyl 2-[3-[2-[[(E)-3-pyridin-3-ylprop-2-enoyl]amino]ethyl]phenoxy]acetate
Names & synonyms
AZUBNVGVLOFQAI-BQYQJAHWSA-NMethyl [3-[2-[(E)-3-(3-pyridyl)acryloylamino]-ethyl]phenoxy]acetatemethyl [3-[2-[(E)-3-(3-pyridyl)acryloylamino]ethyl]phenoxy]acetate
Database identifiers
- PubChem CID
- 20701346
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 77.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 453
Related reactions
2 records
Compound notes
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