Basic information
- Standard SMILES
COc1cc(OC2CCN(C(=O)OC(C)(C)C)CC2)c(F)cc1C(=O)O- InChIKey
YKEOXZVAFGXOFV-UHFFFAOYSA-N- Molecular formula
- C18H24FNO6
- Average molar mass
- 369.4 g/mol
Names & identifiers
- Preferred name
- 4-(N-t-butyloxycarbonyl-4-piperidinyloxy)-5-fluoro-2-methoxybenzoic acid
- IUPAC
- 5-fluoro-2-methoxy-4-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]oxybenzoic acid
Names & synonyms
SCHEMBL7363943YKEOXZVAFGXOFV-UHFFFAOYSA-N4-(N-t-butyloxycarbonyl-4-piperidinyloxy)-5-fluoro-2-methoxybenzoic acid
Database identifiers
- PubChem CID
- 9864117
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 85.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 500
Related reactions
2 records
Compound notes
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