1-ethyl-5,8-bis(oxidanyl)-4-oxidanylidene-6-phenylsulfanyl-quinoline-3-carboxylic acid

Systemtic Name: 1-ethyl-5,8-bis(oxidanyl)-4-oxidanylidene-6-phenylsulfanyl-quinoline-3-carboxylic acid Openeye Name: 1-ethyl-5,8-dihydroxy-4-oxo-6-phenylsulfanyl-quinoline-3-carboxylic acid CAS Name: 1-ethyl-5,8-dihydroxy-4-oxo-6-(phenylthio)-3-quinolinecarboxylic acid IUPAC Name: 1-ethyl-5,8-dihydroxy-4-oxo-6-phenylsulfanylquinoline-3-carboxylic acid Traditional Name: 1-ethyl-5,8-dihydroxy-4-keto-6-(phenylthio)quinoline-3-carboxylic acid Formula: C18H15NO5S MolecularWeight: 357.3804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=C1C(=CC(=C2O)SC3=CC=CC=C3)O)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=C1C(=CC(=C2O)SC3=CC=CC=C3)O)C(=O)O

InChI

InChI=1S/C18H15NO5S/c1-2-19-9-11(18(23)24)16(21)14-15(19)12(20)8-13(17(14)22)25-10-6-4-3-5-7-10/h3-9,20,22H,2H2,1H3,(H,23,24)