4aH-[1,3]benzothiazolo[3,2-b]isoquinolin-12-ium-11-one

Systemtic Name: 4aH-[1,3]benzothiazolo[3,2-b]isoquinolin-12-ium-11-one Openeye Name: 4aH-[1,3]benzothiazolo[3,2-b]isoquinolin-12-ium-11-one CAS Name: 4aH-[1,3]benzothiazolo[3,2-b]isoquinolin-12-ium-11-one IUPAC Name: 4aH-[1,3]benzothiazolo[3,2-b]isoquinolin-12-ium-11-one Traditional Name: 4aH-[1,3]benzothiazol[3,2-b]isoquinolin-12-ium-11-one Formula: C15H10NOS+ MolecularWeight: 252.311

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C3[N+](=C4C=CC=CC4S3)C2=O

Isomeric SMILES

C1=CC=C2C(=C1)C=C3[N+](=C4C=CC=CC4S3)C2=O

InChI

InChI=1S/C15H10NOS/c17-15-11-6-2-1-5-10(11)9-14-16(15)12-7-3-4-8-13(12)18-14/h1-9,13H/q+1