Pivalic acid 6-(2-ethylamino-5-methoxyphenyl)-5,6,7,8-tetrahydronaphthalen-2-yl ester
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Basic information
- Standard SMILES
CCNc1ccc(OC)cc1C1CCc2cc(OC(=O)C(C)(C)C)ccc2C1- InChIKey
YAPXUDLXBQNRJP-UHFFFAOYSA-N- Molecular formula
- C24H31NO3
- Average molar mass
- 381.5 g/mol
Names & identifiers
- Preferred name
- Pivalic acid 6-(2-ethylamino-5-methoxyphenyl)-5,6,7,8-tetrahydronaphthalen-2-yl ester
- IUPAC
- [6-[2-(ethylamino)-5-methoxyphenyl]-5,6,7,8-tetrahydronaphthalen-2-yl] 2,2-dimethylpropanoate
Names & synonyms
SCHEMBL227490YAPXUDLXBQNRJP-UHFFFAOYSA-Npivalic acid 6-(2-ethylamino-5-methoxyphenyl)-5,6,7,8-tetrahydronaphthalen-2-yl ester
Database identifiers
- PubChem CID
- 57934366
Properties
Computed structural propertiesFilling in
- XLogP
- 6
- Topological polar surface area
- 47.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 514
Related reactions
6 records
Compound notes
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