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Basic information
- Standard SMILES
C=Cc1cc(C)c(C=O)c2ccn(S(=O)(=O)c3ccc(C)cc3)c12- InChIKey
YBSHAZURVKJKQG-UHFFFAOYSA-N- Molecular formula
- C19H17NO3S
- Average molar mass
- 339.4 g/mol
- Monoisotopic mass
- 339.09291458
Names & identifiers
- Preferred name
- 5-Methyl-1-tosyl-7-vinyl-1H-indole-4-carbaldehyde
- IUPAC
- 7-ethenyl-5-methyl-1-(4-methylphenyl)sulfonylindole-4-carbaldehyde
Names & synonyms
SCHEMBL15365429YBSHAZURVKJKQG-UHFFFAOYSA-N5-Methyl-1-tosyl-7-vinyl-1H-indole-4-carbaldehyde
Database identifiers
- PubChem CID
- 72192145
Properties
Computed structural propertiesFilling in
- XLogP
- 4.2
- Topological polar surface area
- 64.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 574
Related reactions
2 records
Compound notes
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