4-(5-chloranylquinolin-8-yl)oxy-3-phenylsulfanyl-butanoate

Systemtic Name: 4-(5-chloranylquinolin-8-yl)oxy-3-phenylsulfanyl-butanoate Openeye Name: 4-[(5-chloro-8-quinolyl)oxy]-3-phenylsulfanyl-butanoate CAS Name: 4-[(5-chloro-8-quinolinyl)oxy]-3-(phenylthio)butanoate IUPAC Name: 4-(5-chloroquinolin-8-yl)oxy-3-phenylsulfanylbutanoate Traditional Name: 4-[(5-chloro-8-quinolyl)oxy]-3-(phenylthio)butyrate Formula: C19H15ClNO3S- MolecularWeight: 372.8453

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC(CC(=O)[O-])COC2=C3C(=C(C=C2)Cl)C=CC=N3

Isomeric SMILES

C1=CC=C(C=C1)SC(CC(=O)[O-])COC2=C3C(=C(C=C2)Cl)C=CC=N3

InChI

InChI=1S/C19H16ClNO3S/c20-16-8-9-17(19-15(16)7-4-10-21-19)24-12-14(11-18(22)23)25-13-5-2-1-3-6-13/h1-10,14H,11-12H2,(H,22,23)/p-1