2-(1-methyl-2-oxidanylidene-quinolin-4-yl)sulfanylethanoate

Systemtic Name: 2-(1-methyl-2-oxidanylidene-quinolin-4-yl)sulfanylethanoate Openeye Name: 2-[(1-methyl-2-oxo-4-quinolyl)sulfanyl]acetate CAS Name: 2-[(1-methyl-2-oxo-4-quinolinyl)thio]acetate IUPAC Name: 2-(1-methyl-2-oxoquinolin-4-yl)sulfanylacetate Traditional Name: 2-[(2-keto-1-methyl-4-quinolyl)thio]acetate Formula: C12H10NO3S- MolecularWeight: 248.2777

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=CC1=O)SCC(=O)[O-]

Isomeric SMILES

CN1C2=CC=CC=C2C(=CC1=O)SCC(=O)[O-]

InChI

InChI=1S/C12H11NO3S/c1-13-9-5-3-2-4-8(9)10(6-11(13)14)17-7-12(15)16/h2-6H,7H2,1H3,(H,15,16)/p-1