Basic information
- Standard SMILES
CC(C)(C)OC(=O)N1CCC(Oc2ccc(OCC(=O)O)cc2)CC1- InChIKey
DLKYUPPVHRQQTE-UHFFFAOYSA-N- Molecular formula
- C18H25NO6
- Average molar mass
- 351.4 g/mol
- Monoisotopic mass
- 351.16818752
Names & identifiers
- Preferred name
- 4-(1-Tert-butoxycarbonylpiperidin-4-yloxy)phenoxyacetic acid
- IUPAC
- 2-[4-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]oxyphenoxy]acetic acid
Names & synonyms
4-(1-tert-butoxycarbonylpiperidin-4-yloxy)phenoxyacetic acid247133-55-72-[4-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]oxyphenoxy]acetic acidSCHEMBL6189754DLKYUPPVHRQQTE-UHFFFAOYSA-NA1-08855
Database identifiers
- PubChem CID
- 18536331
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 85.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 445
Related reactions
3 records
Compound notes
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