Basic information
- Standard SMILES
CCOC(=O)C=C1CCC=C1N1CCOCC1- InChIKey
VVQFLWDFZUIVDL-UHFFFAOYSA-N- Molecular formula
- C13H19NO3
- Average molar mass
- 237.29 g/mol
Names & identifiers
- Preferred name
- Ethyl 2-(2-morpholinocyclopent-2-en-1-ylidene)acetate
- IUPAC
- ethyl 2-(2-morpholin-4-ylcyclopent-2-en-1-ylidene)acetate
Names & synonyms
380350-42-5Ethyl 2-(2-morpholinocyclopent-2-en-1-ylidene)acetateMFCD03150476WAY-629413Etrasimod impurity 22Etrasimod Impurity 58N-Etrasimod Impurity 23Oprea1_266958SCHEMBL2233933ethyl 2-(2-morpholin-4-ylcyclopent-2-en-1-ylidene)acetateVVQFLWDFZUIVDL-UHFFFAOYSA-NAKOS034458143
Show more names
SY523954DB-202666ethyl 2-(2-morpholinocyclopent-2-enylidene)acetateEthyl-2-(2-morpholinocyclopent-2-en-1-ylidene)acetate2-[2-(4-Morpholinyl)-2-cyclopenten-1-ylidene]acetic acid ethyl ester
Database identifiers
- PubChem CID
- 4066927
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 38.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 341
Related reactions
3 records
Compound notes
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