3-(4-oxidanylquinolin-1-ium-3-yl)sulfanyl-1H-quinolin-4-one chloride

Systemtic Name: 3-(4-oxidanylquinolin-1-ium-3-yl)sulfanyl-1H-quinolin-4-one chloride Openeye Name: 3-(4-hydroxyquinolin-1-ium-3-yl)sulfanyl-1H-quinolin-4-one chloride CAS Name: 3-[(4-hydroxy-3-quinolin-1-iumyl)thio]-1H-quinolin-4-one chloride IUPAC Name: 3-(4-hydroxyquinolin-1-ium-3-yl)sulfanyl-1H-quinolin-4-one chloride Traditional Name: 3-[(4-hydroxyquinolin-1-ium-3-yl)thio]-4-quinolone chloride Formula: C18H13ClN2O2S MolecularWeight: 356.82602

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C(=CN2)SC3=C(C4=CC=CC=C4[NH+]=C3)O.[Cl-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C(=CN2)SC3=C(C4=CC=CC=C4[NH+]=C3)O.[Cl-]

InChI

InChI=1S/C18H12N2O2S.ClH/c21-17-11-5-1-3-7-13(11)19-9-15(17)23-16-10-20-14-8-4-2-6-12(14)18(16)22;/h1-10H,(H,19,21)(H,20,22);1H