Basic information
- Standard SMILES
CCn1c(=O)c(CC(=O)OC)cc2ccc(OCCCCNC(=O)OC(C)(C)C)cc21- InChIKey
AAXHURUONOKKCC-UHFFFAOYSA-N- Molecular formula
- C23H32N2O6
- Average molar mass
- 432.5 g/mol
- Monoisotopic mass
- 432.22603674
Names & identifiers
- Preferred name
- [7-(4-tert-Butoxycarbonylaminobutoxy)-1-ethyl-2-oxo-1,2-dihydro-quinolin-3-yl]acetic Acid Methyl Ester
- IUPAC
- methyl 2-[1-ethyl-7-[4-[(2-methylpropan-2-yl)oxycarbonylamino]butoxy]-2-oxoquinolin-3-yl]acetate
Names & synonyms
SCHEMBL7073377AAXHURUONOKKCC-UHFFFAOYSA-N[7-(4-tert-Butoxycarbonylaminobutoxy)-1-ethyl-2-oxo-1,2-dihydro-quinolin-3-yl]acetic Acid Methyl Ester
Database identifiers
- PubChem CID
- 69978658
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 94.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 12
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 669
Related reactions
4 records
Compound notes
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