5-(dioxidanylmethyl)-2-[tris(bromanyl)methylsulfonyl]-1,3-benzothiazole

Systemtic Name: 5-(dioxidanylmethyl)-2-[tris(bromanyl)methylsulfonyl]-1,3-benzothiazole Openeye Name: 5-(hydroperoxymethyl)-2-(tribromomethylsulfonyl)-1,3-benzothiazole CAS Name: 5-(hydroperoxymethyl)-2-(tribromomethylsulfonyl)-1,3-benzothiazole IUPAC Name: 5-(hydroperoxymethyl)-2-(tribromomethylsulfonyl)-1,3-benzothiazole Traditional Name: 5-(hydroperoxymethyl)-2-(tribromomethylsulfonyl)-1,3-benzothiazole Formula: C9H6Br3NO4S2 MolecularWeight: 495.99024

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1COO)N=C(S2)S(=O)(=O)C(Br)(Br)Br

Isomeric SMILES

C1=CC2=C(C=C1COO)N=C(S2)S(=O)(=O)C(Br)(Br)Br

InChI

InChI=1S/C9H6Br3NO4S2/c10-9(11,12)19(15,16)8-13-6-3-5(4-17-14)1-2-7(6)18-8/h1-3,14H,4H2