3-heptyl-2-methyl-2H-1,3-benzothiazole iodide

Systemtic Name: 3-heptyl-2-methyl-2H-1,3-benzothiazole iodide Openeye Name: 3-heptyl-2-methyl-2H-1,3-benzothiazole iodide CAS Name: 3-heptyl-2-methyl-2H-1,3-benzothiazole iodide IUPAC Name: 3-heptyl-2-methyl-2H-1,3-benzothiazole iodide Traditional Name: 3-heptyl-2-methyl-2H-1,3-benzothiazole iodide Formula: C15H23INS- MolecularWeight: 376.31929

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1C(SC2=CC=CC=C21)C.[I-]

Isomeric SMILES

CCCCCCCN1C(SC2=CC=CC=C21)C.[I-]

InChI

InChI=1S/C15H23NS.HI/c1-3-4-5-6-9-12-16-13(2)17-15-11-8-7-10-14(15)16;/h7-8,10-11,13H,3-6,9,12H2,1-2H3;1H/p-1