(7-methoxy-4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)azanium iodide

Systemtic Name: (7-methoxy-4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)azanium iodide Openeye Name: (7-methoxy-4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)ammonium iodide CAS Name: (7-methoxy-4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)ammonium iodide IUPAC Name: (7-methoxy-4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)azanium iodide Traditional Name: (7-methoxy-4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)ammonium iodide Formula: C12H13IN2OS MolecularWeight: 360.21389

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C3=C(CC2)SC(=N3)[NH3+].[I-]

Isomeric SMILES

COC1=CC2=C(C=C1)C3=C(CC2)SC(=N3)[NH3+].[I-]

InChI

InChI=1S/C12H12N2OS.HI/c1-15-8-3-4-9-7(6-8)2-5-10-11(9)14-12(13)16-10;/h3-4,6H,2,5H2,1H3,(H2,13,14);1H