Basic information
- Standard SMILES
O=C(OCc1ccccc1)N1CCC(OCCOCc2ccccc2)C1- InChIKey
LCNSGMJIDLDHJC-UHFFFAOYSA-N- Molecular formula
- C21H25NO4
- Average molar mass
- 355.4 g/mol
- Monoisotopic mass
- 355.17835828
Names & identifiers
- Preferred name
- Benzyl 3-(2-benzyloxyethoxy)pyrrolidine-1-carboxylate
- IUPAC
- benzyl 3-(2-phenylmethoxyethoxy)pyrrolidine-1-carboxylate
Names & synonyms
1404531-44-7Benzyl 3-(2-benzyloxyethoxy)pyrrolidine-1-carboxylateSCHEMBL13519203LCNSGMJIDLDHJC-UHFFFAOYSA-NDA-45273
Database identifiers
- PubChem CID
- 70927043
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 48 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 405
Related reactions
1 records
Compound notes
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