Basic information
- Standard SMILES
CC(C)(C)OC(=O)n1cc(C=CC(=O)N2CCOCC2)c2cc(OCc3ccccc3)ccc21- InChIKey
SEDWYYPHNRSORZ-UHFFFAOYSA-N- Molecular formula
- C27H30N2O5
- Average molar mass
- 462.5 g/mol
- Monoisotopic mass
- 462.21547206
Names & identifiers
- Preferred name
- Tert-butyl 3-(3-morpholin-4-yl-3-oxoprop-1-enyl)-5-phenylmethoxyindole-1-carboxylate
- IUPAC
- tert-butyl 3-(3-morpholin-4-yl-3-oxoprop-1-enyl)-5-phenylmethoxyindole-1-carboxylate
Names & synonyms
SCHEMBL1958264
Database identifiers
- PubChem CID
- 67227352
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 70 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 721
Related reactions
1 records
Compound notes
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