Basic information
- Standard SMILES
CC(C)(C)OC(=O)COc1cccc(CN(Cc2ccc(C(C)(C)CO[Si](C)(C)C(C)(C)C)cc2)S(=O)(=O)c2cccnc2)c1- InChIKey
YNGSDTAFOLOCTL-UHFFFAOYSA-N- Molecular formula
- C35H50N2O6SSi
- Average molar mass
- 654.9 g/mol
- Monoisotopic mass
- 654.31588503
Names & identifiers
- Preferred name
- (3-{[{4-[2-(tert-Butyl-dimethyl-silanyloxy)-1,1-dimethyl-ethyl]-benzyl}-(pyridine-3-sulfonyl)-amino]-methyl}-phenoxy)-acetic acid tert-butyl ester
- IUPAC
- tert-butyl 2-[3-[[[4-[1-[tert-butyl(dimethyl)silyl]oxy-2-methylpropan-2-yl]phenyl]methyl-pyridin-3-ylsulfonylamino]methyl]phenoxy]acetate
Names & synonyms
SCHEMBL6276340YNGSDTAFOLOCTL-UHFFFAOYSA-N(3-{[{4-[2-(tert-Butyl-dimethyl-silanyloxy)-1,1-dimethyl-ethyl]-benzyl}-(pyridine-3-sulfonyl)-amino]-methyl}-phenoxy)-acetic acid tert-butyl ester
Database identifiers
- PubChem CID
- 69729909
Properties
Computed structural properties
- Topological polar surface area
- 103 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 16
- Heavy atoms
- 45
- Formal charge
- 0
- Complexity
- 1,040
Related reactions
4 records
Compound notes
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