5,7-bis(chloranyl)quinolin-8-ol; 5-chloranylquinolin-8-ol; 8-oxidanylquinoline-5-sulfonic acid; quinolin-8-ol

Systemtic Name: 5,7-bis(chloranyl)quinolin-8-ol; 5-chloranylquinolin-8-ol; 8-oxidanylquinoline-5-sulfonic acid; quinolin-8-ol Openeye Name: 5-chloroquinolin-8-ol; 5,7-dichloroquinolin-8-ol; 8-hydroxyquinoline-5-sulfonic acid; quinolin-8-ol CAS Name: 5-chloro-8-quinolinol; 5,7-dichloro-8-quinolinol; 8-hydroxy-5-quinolinesulfonic acid; 8-quinolinol IUPAC Name: 5-chloroquinolin-8-ol; 5,7-dichloroquinolin-8-ol; 8-hydroxyquinoline-5-sulfonic acid; quinolin-8-ol Traditional Name: 5-chloroquinolin-8-ol; 5,7-dichloroquinolin-8-ol; 8-hydroxyquinoline-5-sulfonic acid; oxine Formula: C36H25Cl3N4O7S MolecularWeight: 764.0303

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)O)N=CC=C2.C1=CC2=C(C=CC(=C2N=C1)O)S(=O)(=O)O.C1=CC2=C(C=CC(=C2N=C1)O)Cl.C1=CC2=C(C(=C(C=C2Cl)Cl)O)N=C1

Isomeric SMILES

C1=CC2=C(C(=C1)O)N=CC=C2.C1=CC2=C(C=CC(=C2N=C1)O)S(=O)(=O)O.C1=CC2=C(C=CC(=C2N=C1)O)Cl.C1=CC2=C(C(=C(C=C2Cl)Cl)O)N=C1

InChI

InChI=1S/C9H5Cl2NO.C9H6ClNO.C9H7NO4S.C9H7NO/c10-6-4-7(11)9(13)8-5(6)2-1-3-12-8;10-7-3-4-8(12)9-6(7)2-1-5-11-9;11-7-3-4-8(15(12,13)14)6-2-1-5-10-9(6)7;11-8-5-1-3-7-4-2-6-10-9(7)8/h1-4,13H;1-5,12H;1-5,11H,(H,12,13,14);1-6,11H