Basic information
- Standard SMILES
COC(=O)COc1cccc(C(NC(=O)OC(C)(C)C)c2ccccc2)c1- InChIKey
DBHWADUJKOFSBM-UHFFFAOYSA-N- Molecular formula
- C21H25NO5
- Average molar mass
- 371.4 g/mol
- Monoisotopic mass
- 371.1732729
Names & identifiers
- Preferred name
- Methyl 2-(3-(((tert-butoxycarbonyl)amino)(phenyl)methyl)phenoxy)acetate
- IUPAC
- methyl 2-[3-[[(2-methylpropan-2-yl)oxycarbonylamino]-phenylmethyl]phenoxy]acetate
Names & synonyms
SCHEMBL14166340DBHWADUJKOFSBM-UHFFFAOYSA-NMethyl 2-(3-(((tert-butoxycarbonyl)amino)(phenyl)methyl)phenoxy)acetate
Database identifiers
- PubChem CID
- 71093308
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 73.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 481
Related reactions
1 records
Compound notes
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