6-(2-methyl-2H-1,3-benzothiazol-3-yl)hexanoic acid bromide

Systemtic Name: 6-(2-methyl-2H-1,3-benzothiazol-3-yl)hexanoic acid bromide Openeye Name: 6-(2-methyl-2H-1,3-benzothiazol-3-yl)hexanoic acid bromide CAS Name: 6-(2-methyl-2H-1,3-benzothiazol-3-yl)hexanoic acid bromide IUPAC Name: 6-(2-methyl-2H-1,3-benzothiazol-3-yl)hexanoic acid bromide Traditional Name: 6-(2-methyl-2H-1,3-benzothiazol-3-yl)hexanoic acid bromide Formula: C14H19BrNO2S- MolecularWeight: 345.27516

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Descriptors Computed from Structure

Canonical SMILES:

CC1N(C2=CC=CC=C2S1)CCCCCC(=O)O.[Br-]

Isomeric SMILES

CC1N(C2=CC=CC=C2S1)CCCCCC(=O)O.[Br-]

InChI

InChI=1S/C14H19NO2S.BrH/c1-11-15(10-6-2-3-9-14(16)17)12-7-4-5-8-13(12)18-11;/h4-5,7-8,11H,2-3,6,9-10H2,1H3,(H,16,17);1H/p-1