Basic information
- Standard SMILES
C[C@@H](O)COc1ccc([C@@H](NC(=O)OC(C)(C)C)C(=O)O)cc1- InChIKey
NDLYBDDLFMFTBV-ZWNOBZJWSA-N- Molecular formula
- C16H23NO6
- Average molar mass
- 325.36 g/mol
Names & identifiers
- Preferred name
- (R)-tert-Butoxycarbonylamino-[4-((R)-2-hydroxy-propoxy)-phenyl]-acetic acid
- IUPAC
- (2R)-2-[4-[(2R)-2-hydroxypropoxy]phenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetic acid
Names & synonyms
SCHEMBL3379286NDLYBDDLFMFTBV-ZWNOBZJWSA-N(R)-tert-Butoxycarbonylamino-[4-((R)-2-hydroxy-propoxy)-phenyl]-acetic acid
Database identifiers
- PubChem CID
- 68620103
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 398
Related reactions
1 records
Compound notes
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