sodium 2-(2-methylquinolin-4-yl)sulfanylethanoate

Systemtic Name: sodium 2-(2-methylquinolin-4-yl)sulfanylethanoate Openeye Name: sodium 2-[(2-methyl-4-quinolyl)sulfanyl]acetate CAS Name: sodium 2-[(2-methyl-4-quinolinyl)thio]acetate IUPAC Name: sodium 2-(2-methylquinolin-4-yl)sulfanylacetate Traditional Name: sodium 2-[(2-methyl-4-quinolyl)thio]acetate Formula: C12H10NNaO2S MolecularWeight: 255.26807

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)SCC(=O)[O-].[Na+]

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)SCC(=O)[O-].[Na+]

InChI

InChI=1S/C12H11NO2S.Na/c1-8-6-11(16-7-12(14)15)9-4-2-3-5-10(9)13-8;/h2-6H,7H2,1H3,(H,14,15);/q;+1/p-1