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

Systemtic Name: 2-(4-bromanylbutyl)-5-methoxy-1,2-benzothiazol-3-one Openeye Name: 2-(4-bromobutyl)-5-methoxy-1,2-benzothiazol-3-one CAS Name: 2-(4-bromobutyl)-5-methoxy-1,2-benzothiazol-3-one IUPAC Name: 2-(4-bromobutyl)-5-methoxy-1,2-benzothiazol-3-one Traditional Name: 2-(4-bromobutyl)-5-methoxy-1,2-benzothiazol-3-one Formula: C12H14BrNO2S MolecularWeight: 316.21406

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)SN(C2=O)CCCCBr

Isomeric SMILES

COC1=CC2=C(C=C1)SN(C2=O)CCCCBr

InChI

InChI=1S/C12H14BrNO2S/c1-16-9-4-5-11-10(8-9)12(15)14(17-11)7-3-2-6-13/h4-5,8H,2-3,6-7H2,1H3