Methyl 4-(acetyloxy)-3-[(acetyloxy)methyl]-2-benzamidobut-2-enoate
Basic information
- CAS
93730-01-9- Standard SMILES
COC(=O)C(NC(=O)c1ccccc1)=C(COC(C)=O)COC(C)=O- InChIKey
ZVUBPPOZUCMYRN-UHFFFAOYSA-N- Molecular formula
- C17H19NO7
- Average molar mass
- 349.3 g/mol
- Monoisotopic mass
- 349.11615195
Names & identifiers
- Preferred name
- Methyl 4-(acetyloxy)-3-[(acetyloxy)methyl]-2-benzamidobut-2-enoate
- IUPAC
- methyl 4-acetyloxy-3-(acetyloxymethyl)-2-benzamidobut-2-enoate
Names & synonyms
93730-01-9NSC151773DTXSID30302529Methyl 4-(acetyloxy)-3-[(acetyloxy)methyl]-2-benzamidobut-2-enoateNSC-151773
Database identifiers
- CAS
93730-01-9- PubChem CID
- 289595
- DTXSID
DTXSID30302529
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 108 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 10
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 527
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Compound notes
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