Basic information
- Standard SMILES
CCOC(=O)C1CC1c1c(C)n(Cc2ccc(Br)cc2)c2ccc(OC)cc12- InChIKey
RRSHAQBWWVMMQX-UHFFFAOYSA-N- Molecular formula
- C23H24BrNO3
- Average molar mass
- 442.3 g/mol
Names & identifiers
- Preferred name
- Ethyl 2-[1-(p-bromobenzyl)-5-methoxy-2-methylindol-3-yl]cyclopropanecarboxylate
- IUPAC
- ethyl 2-[1-[(4-bromophenyl)methyl]-5-methoxy-2-methylindol-3-yl]cyclopropane-1-carboxylate
Names & synonyms
SCHEMBL8877569RRSHAQBWWVMMQX-UHFFFAOYSA-NEthyl 2-[1-(p-bromobenzyl)-5-methoxy-2-methylindol-3-yl]cyclopropanecarboxylate
Database identifiers
- PubChem CID
- 19974929
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 550
Related reactions
1 records
Compound notes
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