2-(4-bromanylbutyl)-4,5-bis(oxidanyl)-1,2-benzothiazol-3-one

Systemtic Name: 2-(4-bromanylbutyl)-4,5-bis(oxidanyl)-1,2-benzothiazol-3-one Openeye Name: 2-(4-bromobutyl)-4,5-dihydroxy-1,2-benzothiazol-3-one CAS Name: 2-(4-bromobutyl)-4,5-dihydroxy-1,2-benzothiazol-3-one IUPAC Name: 2-(4-bromobutyl)-4,5-dihydroxy-1,2-benzothiazol-3-one Traditional Name: 2-(4-bromobutyl)-4,5-dihydroxy-1,2-benzothiazol-3-one Formula: C11H12BrNO3S MolecularWeight: 318.18688

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1O)O)C(=O)N(S2)CCCCBr

Isomeric SMILES

C1=CC2=C(C(=C1O)O)C(=O)N(S2)CCCCBr

InChI

InChI=1S/C11H12BrNO3S/c12-5-1-2-6-13-11(16)9-8(17-13)4-3-7(14)10(9)15/h3-4,14-15H,1-2,5-6H2