5-(bromomethyl)-7-tert-butyl-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-one

Systemtic Name: 5-(bromomethyl)-7-tert-butyl-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-one Openeye Name: 5-(bromomethyl)-7-tert-butyl-1,1-dioxo-1,2-benzothiazol-3-one CAS Name: 5-(bromomethyl)-7-tert-butyl-1,1-dioxo-1,2-benzothiazol-3-one IUPAC Name: 5-(bromomethyl)-7-tert-butyl-1,1-dioxo-1,2-benzothiazol-3-one Traditional Name: 5-(bromomethyl)-7-tert-butyl-1,1-diketo-1,2-benzothiazol-3-one Formula: C12H14BrNO3S MolecularWeight: 332.21346

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C2C(=CC(=C1)CBr)C(=O)NS2(=O)=O

Isomeric SMILES

CC(C)(C)C1=C2C(=CC(=C1)CBr)C(=O)NS2(=O)=O

InChI

InChI=1S/C12H14BrNO3S/c1-12(2,3)9-5-7(6-13)4-8-10(9)18(16,17)14-11(8)15/h4-5H,6H2,1-3H3,(H,14,15)