3-(3-bromanylpropyl)-1,3-benzothiazol-3-ium bromide

Systemtic Name: 3-(3-bromanylpropyl)-1,3-benzothiazol-3-ium bromide Openeye Name: 3-(3-bromopropyl)-1,3-benzothiazol-3-ium bromide CAS Name: 3-(3-bromopropyl)-1,3-benzothiazol-3-ium bromide IUPAC Name: 3-(3-bromopropyl)-1,3-benzothiazol-3-ium bromide Traditional Name: 3-(3-bromopropyl)-1,3-benzothiazol-3-ium bromide Formula: C10H11Br2NS MolecularWeight: 337.07404

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)[N+](=CS2)CCCBr.[Br-]

Isomeric SMILES

C1=CC=C2C(=C1)[N+](=CS2)CCCBr.[Br-]

InChI

InChI=1S/C10H11BrNS.BrH/c11-6-3-7-12-8-13-10-5-2-1-4-9(10)12;/h1-2,4-5,8H,3,6-7H2;1H/q+1;/p-1