Basic information
- Standard SMILES
CCOC(=O)c1cc2cc(CCC(=O)OC(C)(C)C)ccc2[nH]1- InChIKey
FFVNGCNMSRLHFG-UHFFFAOYSA-N- Molecular formula
- C18H23NO4
- Average molar mass
- 317.4 g/mol
Names & identifiers
- Preferred name
- 5-(2-tert-butoxycarbonyl-ethyl)-1H-indole-2-carboxylic acid ethyl ester
- IUPAC
- ethyl 5-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]-1H-indole-2-carboxylate
Names & synonyms
SCHEMBL5842585FFVNGCNMSRLHFG-UHFFFAOYSA-N5-(2-tert-butoxycarbonyl-ethyl)-1H-indole-2-carboxylic acid ethyl ester
Database identifiers
- PubChem CID
- 69587136
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 68.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 429
Related reactions
6 records
Compound notes
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