Basic information
- Standard SMILES
CC(C)(C)OC(=O)CN(CCOS(C)(=O)=O)C(=O)OCc1ccccc1- InChIKey
NJXDUGMQYBSJEQ-UHFFFAOYSA-N- Molecular formula
- C17H25NO7S
- Average molar mass
- 387.4 g/mol
Names & identifiers
- Preferred name
- N-Benzyloxycarbonyl-N-[2-(methanesulphonyloxy)ethyl]-glycine tert-butyl ester
- IUPAC
- tert-butyl 2-[2-methylsulfonyloxyethyl(phenylmethoxycarbonyl)amino]acetate
Names & synonyms
SCHEMBL8542598NJXDUGMQYBSJEQ-UHFFFAOYSA-NN-Benzyloxycarbonyl-N-[2-(methanesulphonyloxy)ethyl]-glycine tert-butyl ester
Database identifiers
- PubChem CID
- 19959619
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 108 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 11
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 557
Related reactions
2 records
Compound notes
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