2-(4-bromanylbutyl)-6-nitro-1,2-benzothiazol-3-one

Systemtic Name: 2-(4-bromanylbutyl)-6-nitro-1,2-benzothiazol-3-one Openeye Name: 2-(4-bromobutyl)-6-nitro-1,2-benzothiazol-3-one CAS Name: 2-(4-bromobutyl)-6-nitro-1,2-benzothiazol-3-one IUPAC Name: 2-(4-bromobutyl)-6-nitro-1,2-benzothiazol-3-one Traditional Name: 2-(4-bromobutyl)-6-nitro-1,2-benzothiazol-3-one Formula: C11H11BrN2O3S MolecularWeight: 331.18564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])SN(C2=O)CCCCBr

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])SN(C2=O)CCCCBr

InChI

InChI=1S/C11H11BrN2O3S/c12-5-1-2-6-13-11(15)9-4-3-8(14(16)17)7-10(9)18-13/h3-4,7H,1-2,5-6H2