[(6-chloranyl-2-oxidanylidene-1H-quinolin-4-yl)-methylsulfanyl-methyl] ethanoate

Systemtic Name: [(6-chloranyl-2-oxidanylidene-1H-quinolin-4-yl)-methylsulfanyl-methyl] ethanoate Openeye Name: [(6-chloro-2-oxo-1H-quinolin-4-yl)-methylsulfanyl-methyl] acetate CAS Name: acetic acid [(6-chloro-2-oxo-1H-quinolin-4-yl)-(methylthio)methyl] ester IUPAC Name: [(6-chloro-2-oxo-1H-quinolin-4-yl)-methylsulfanylmethyl] acetate Traditional Name: acetic acid [(6-chloro-2-keto-1H-quinolin-4-yl)-(methylthio)methyl] ester Formula: C13H12ClNO3S MolecularWeight: 297.75728

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C1=CC(=O)NC2=C1C=C(C=C2)Cl)SC

Isomeric SMILES

CC(=O)OC(C1=CC(=O)NC2=C1C=C(C=C2)Cl)SC

InChI

InChI=1S/C13H12ClNO3S/c1-7(16)18-13(19-2)10-6-12(17)15-11-4-3-8(14)5-9(10)11/h3-6,13H,1-2H3,(H,15,17)