Basic information
- Standard SMILES
CCOC(=O)C(=C1CCCN1C)c1ccc([N+](=O)[O-])cc1- InChIKey
YOYYNUYOKYAWGN-UHFFFAOYSA-N- Molecular formula
- C15H18N2O4
- Average molar mass
- 290.31 g/mol
Names & identifiers
- Preferred name
- 2-(alpha-Ethoxycarbonyl-4-nitrobenzylidene)-1-methylpyrrolidine
- IUPAC
- ethyl 2-(1-methylpyrrolidin-2-ylidene)-2-(4-nitrophenyl)acetate
Names & synonyms
SCHEMBL11377808YOYYNUYOKYAWGN-UHFFFAOYSA-N2-(alpha-ethoxycarbonyl-4-nitrobenzylidene)-1-methylpyrrolidine
Database identifiers
- PubChem CID
- 54519793
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 75.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 433
Related reactions
2 records
Compound notes
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