Basic information
- Standard SMILES
O=C1CC[C@@H](c2ccc(C=CS(=O)(=O)N3CCOCC3)cc2)C1- InChIKey
ASJVBPZODCRIOI-MRXNPFEDSA-N- Molecular formula
- C17H21NO4S
- Average molar mass
- 335.4 g/mol
- Monoisotopic mass
- 335.11912932
Names & identifiers
- Preferred name
- (3R)-3-{4-[2-(Morpholine-4-sulfonyl)-vinyl]-phenyl}-cyclopentanone
- IUPAC
- (3R)-3-[4-(2-morpholin-4-ylsulfonylethenyl)phenyl]cyclopentan-1-one
Names & synonyms
SCHEMBL3698601ASJVBPZODCRIOI-MRXNPFEDSA-N(3R)-3-{4-[2-(Morpholine-4-sulfonyl)-vinyl]-phenyl}-cyclopentanone
Database identifiers
- PubChem CID
- 68748916
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 72.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 537
Related reactions
2 records
Compound notes
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