2-(4-bromanylbutyl)-5-chloranyl-3-oxidanylidene-1,2-benzothiazole-4,6-diolate

Systemtic Name: 2-(4-bromanylbutyl)-5-chloranyl-3-oxidanylidene-1,2-benzothiazole-4,6-diolate Openeye Name: 2-(4-bromobutyl)-5-chloro-3-oxo-1,2-benzothiazole-4,6-diolate CAS Name: 2-(4-bromobutyl)-5-chloro-3-oxo-1,2-benzothiazole-4,6-diolate IUPAC Name: 2-(4-bromobutyl)-5-chloro-3-oxo-1,2-benzothiazole-4,6-diolate Traditional Name: 2-(4-bromobutyl)-5-chloro-3-keto-1,2-benzothiazole-4,6-diolate Formula: C11H9BrClNO3S-2 MolecularWeight: 350.61606

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=C(C2=C1SN(C2=O)CCCCBr)[O-])Cl)[O-]

Isomeric SMILES

C1=C(C(=C(C2=C1SN(C2=O)CCCCBr)[O-])Cl)[O-]

InChI

InChI=1S/C11H11BrClNO3S/c12-3-1-2-4-14-11(17)8-7(18-14)5-6(15)9(13)10(8)16/h5,15-16H,1-4H2/p-2