1-(2-hydroxyethyl)-4-oxidanylidene-6-phenylsulfanyl-quinoline-3-carboxylic acid

Systemtic Name: 1-(2-hydroxyethyl)-4-oxidanylidene-6-phenylsulfanyl-quinoline-3-carboxylic acid Openeye Name: 1-(2-hydroxyethyl)-4-oxo-6-phenylsulfanyl-quinoline-3-carboxylic acid CAS Name: 1-(2-hydroxyethyl)-4-oxo-6-(phenylthio)-3-quinolinecarboxylic acid IUPAC Name: 1-(2-hydroxyethyl)-4-oxo-6-phenylsulfanylquinoline-3-carboxylic acid Traditional Name: 1-(2-hydroxyethyl)-4-keto-6-(phenylthio)quinoline-3-carboxylic acid Formula: C18H15NO4S MolecularWeight: 341.381

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=CC3=C(C=C2)N(C=C(C3=O)C(=O)O)CCO

Isomeric SMILES

C1=CC=C(C=C1)SC2=CC3=C(C=C2)N(C=C(C3=O)C(=O)O)CCO

InChI

InChI=1S/C18H15NO4S/c20-9-8-19-11-15(18(22)23)17(21)14-10-13(6-7-16(14)19)24-12-4-2-1-3-5-12/h1-7,10-11,20H,8-9H2,(H,22,23)