Basic information
- Standard SMILES
COc1ccc(C(O[C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2O)(c2ccccc2)c2ccc(OC)cc2)cc1- InChIKey
CVBNBHLLSHTNKI-SVBPBHIXSA-N- Molecular formula
- C30H35NO6
- Average molar mass
- 505.6 g/mol
- Monoisotopic mass
- 505.24643784
Names & identifiers
- Preferred name
- (3S,4S)-tert-butyl 3-(bis(4-methoxyphenyl)(phenyl)methoxy)-4-hydroxypyrrolidine-1-carboxylate
- IUPAC
- tert-butyl (3S,4S)-3-[bis(4-methoxyphenyl)-phenylmethoxy]-4-hydroxypyrrolidine-1-carboxylate
Names & synonyms
SCHEMBL15398665CVBNBHLLSHTNKI-SVBPBHIXSA-N(3S,4S)-tert-butyl 3-(bis(4-methoxyphenyl)(phenyl)methoxy)-4-hydroxypyrrolidine-1-carboxylate
Database identifiers
- PubChem CID
- 86707461
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 77.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 692
Related reactions
2 records
Compound notes
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