3-methyl-2-(2-phenylethenyl)-1,3-benzothiazol-3-ium iodide

Systemtic Name: 3-methyl-2-(2-phenylethenyl)-1,3-benzothiazol-3-ium iodide Openeye Name: 3-methyl-2-styryl-1,3-benzothiazol-3-ium iodide CAS Name: 3-methyl-2-(2-phenylethenyl)-1,3-benzothiazol-3-ium iodide IUPAC Name: 3-methyl-2-(2-phenylethenyl)-1,3-benzothiazol-3-ium iodide Traditional Name: 3-methyl-2-styryl-1,3-benzothiazol-3-ium iodide Formula: C16H14INS MolecularWeight: 379.25853

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(SC2=CC=CC=C21)C=CC3=CC=CC=C3.[I-]

Isomeric SMILES

C[N+]1=C(SC2=CC=CC=C21)C=CC3=CC=CC=C3.[I-]

InChI

InChI=1S/C16H14NS.HI/c1-17-14-9-5-6-10-15(14)18-16(17)12-11-13-7-3-2-4-8-13;/h2-12H,1H3;1H/q+1;/p-1