6-cyano-N-oxidanyl-11-oxidanylidene-[1,3]benzothiazolo[3,2-b]isoquinolin-9-amine oxide

Systemtic Name: 6-cyano-N-oxidanyl-11-oxidanylidene-[1,3]benzothiazolo[3,2-b]isoquinolin-9-amine oxide Openeye Name: 6-cyano-N-hydroxy-11-oxo-[1,3]benzothiazolo[3,2-b]isoquinolin-9-amine oxide CAS Name: 6-cyano-N-hydroxy-11-oxo-[1,3]benzothiazolo[3,2-b]isoquinolin-9-amine oxide IUPAC Name: 6-cyano-N-hydroxy-11-oxo-[1,3]benzothiazolo[3,2-b]isoquinolin-9-amine oxide Traditional Name: 6-cyano-N-hydroxy-11-keto-[1,3]benzothiazol[3,2-b]isoquinolin-9-amine oxide Formula: C16H9N3O3S MolecularWeight: 323.32596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N3C(=C(C4=C(C3=O)C=C(C=C4)[NH+](O)[O-])C#N)S2

Isomeric SMILES

C1=CC=C2C(=C1)N3C(=C(C4=C(C3=O)C=C(C=C4)[NH+](O)[O-])C#N)S2

InChI

InChI=1S/C16H9N3O3S/c17-8-12-10-6-5-9(19(21)22)7-11(10)15(20)18-13-3-1-2-4-14(13)23-16(12)18/h1-7,19,21H