2-(2-methyl-4-phenyl-quinolin-3-yl)sulfanylethanoate

Systemtic Name: 2-(2-methyl-4-phenyl-quinolin-3-yl)sulfanylethanoate Openeye Name: 2-[(2-methyl-4-phenyl-3-quinolyl)sulfanyl]acetate CAS Name: 2-[(2-methyl-4-phenyl-3-quinolinyl)thio]acetate IUPAC Name: 2-(2-methyl-4-phenylquinolin-3-yl)sulfanylacetate Traditional Name: 2-[(2-methyl-4-phenyl-3-quinolyl)thio]acetate Formula: C18H14NO2S- MolecularWeight: 308.37426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1SCC(=O)[O-])C3=CC=CC=C3

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1SCC(=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C18H15NO2S/c1-12-18(22-11-16(20)21)17(13-7-3-2-4-8-13)14-9-5-6-10-15(14)19-12/h2-10H,11H2,1H3,(H,20,21)/p-1