Basic information
- Standard SMILES
CCOC(=O)CCc1ccc(N(C2CCc3c(-c4c(C)cc(O[Si](C)(C)C(C)(C)C)cc4C)cccc32)S(=O)(=O)c2ccccc2[N+](=O)[O-])cc1F- InChIKey
ADPBDZUVCXRKPV-UHFFFAOYSA-N- Molecular formula
- C40H47FN2O7SSi
- Average molar mass
- 747 g/mol
- Monoisotopic mass
- 746.28572771
Names & identifiers
- Preferred name
- ethyl 3-(4-{[4-(4-{[tert-butyl(dimethyl)silyl]oxy}-2,6-dimethylphenyl)-2,3-dihydro-1H-inden-1-yl][(2-nitrophenyl)sulfonyl]amino}-2-fluorophenyl)propanoate
- IUPAC
- ethyl 3-[4-[[4-[4-[tert-butyl(dimethyl)silyl]oxy-2,6-dimethylphenyl]-2,3-dihydro-1H-inden-1-yl]-(2-nitrophenyl)sulfonylamino]-2-fluorophenyl]propanoate
Names & synonyms
SCHEMBL3632960ADPBDZUVCXRKPV-UHFFFAOYSA-Nethyl 3-(4-{[4-(4-{[tert-butyl(dimethyl)silyl]oxy}-2,6-dimethylphenyl)-2,3-dihydro-1H-inden-1-yl][(2-nitrophenyl)sulfonyl]amino}-2-fluorophenyl)propanoate
Database identifiers
- PubChem CID
- 68720751
Properties
Computed structural properties
- Topological polar surface area
- 127 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 13
- Heavy atoms
- 52
- Formal charge
- 0
- Complexity
- 1,320
Related reactions
1 records
Compound notes
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