ethyl 3-[(8-oxidanylquinolin-5-yl)methylsulfanyl]propanoate

Systemtic Name: ethyl 3-[(8-oxidanylquinolin-5-yl)methylsulfanyl]propanoate Openeye Name: ethyl 3-[(8-hydroxy-5-quinolyl)methylsulfanyl]propanoate CAS Name: 3-[(8-hydroxy-5-quinolinyl)methylthio]propanoic acid ethyl ester IUPAC Name: ethyl 3-[(8-hydroxyquinolin-5-yl)methylsulfanyl]propanoate Traditional Name: 3-[(8-hydroxy-5-quinolyl)methylthio]propionic acid ethyl ester Formula: C15H17NO3S MolecularWeight: 291.36538

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCSCC1=C2C=CC=NC2=C(C=C1)O

Isomeric SMILES

CCOC(=O)CCSCC1=C2C=CC=NC2=C(C=C1)O

InChI

InChI=1S/C15H17NO3S/c1-2-19-14(18)7-9-20-10-11-5-6-13(17)15-12(11)4-3-8-16-15/h3-6,8,17H,2,7,9-10H2,1H3