3-methylsulfanyl-2-phenyl-quinoline-4-carboxylic acid

Systemtic Name: 3-methylsulfanyl-2-phenyl-quinoline-4-carboxylic acid Openeye Name: 3-methylsulfanyl-2-phenyl-quinoline-4-carboxylic acid CAS Name: 3-(methylthio)-2-phenyl-4-quinolinecarboxylic acid IUPAC Name: 3-methylsulfanyl-2-phenylquinoline-4-carboxylic acid Traditional Name: 3-(methylthio)-2-phenyl-cinchoninic acid Formula: C17H13NO2S MolecularWeight: 295.35562

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C2=CC=CC=C2N=C1C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CSC1=C(C2=CC=CC=C2N=C1C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C17H13NO2S/c1-21-16-14(17(19)20)12-9-5-6-10-13(12)18-15(16)11-7-3-2-4-8-11/h2-10H,1H3,(H,19,20)