Basic information
- Standard SMILES
COC(=O)CC1Cc2ccc(OCCN)cc2N(Cc2ccccc2)C1=O- InChIKey
NFNJPNFARSNCFN-UHFFFAOYSA-N- Molecular formula
- C21H24N2O4
- Average molar mass
- 368.4 g/mol
- Monoisotopic mass
- 368.17360725
Names & identifiers
- Preferred name
- [1-Benzyl-7-(2-aminoethoxy)-2-oxo-1,2,3,4-tetrahydro-quinolin-3-yl]acetic Acid Methyl Ester
- IUPAC
- methyl 2-[7-(2-aminoethoxy)-1-benzyl-2-oxo-3,4-dihydroquinolin-3-yl]acetate
Names & synonyms
SCHEMBL7076120NFNJPNFARSNCFN-UHFFFAOYSA-N[1-Benzyl-7-(2-aminoethoxy)-2-oxo-1,2,3,4-tetrahydro-quinolin-3-yl]acetic Acid Methyl Ester
Database identifiers
- PubChem CID
- 69979600
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 81.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 506
Related reactions
2 records
Compound notes
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