3-(5-chloranyl-2-methyl-2H-1,3-benzothiazol-3-yl)propanal bromide

Systemtic Name: 3-(5-chloranyl-2-methyl-2H-1,3-benzothiazol-3-yl)propanal bromide Openeye Name: 3-(5-chloro-2-methyl-2H-1,3-benzothiazol-3-yl)propanal bromide CAS Name: 3-(5-chloro-2-methyl-2H-1,3-benzothiazol-3-yl)propanal bromide IUPAC Name: 3-(5-chloro-2-methyl-2H-1,3-benzothiazol-3-yl)propanal bromide Traditional Name: 3-(5-chloro-2-methyl-2H-1,3-benzothiazol-3-yl)propionaldehyde bromide Formula: C11H12BrClNOS- MolecularWeight: 321.64108

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Descriptors Computed from Structure

Canonical SMILES:

CC1N(C2=C(S1)C=CC(=C2)Cl)CCC=O.[Br-]

Isomeric SMILES

CC1N(C2=C(S1)C=CC(=C2)Cl)CCC=O.[Br-]

InChI

InChI=1S/C11H12ClNOS.BrH/c1-8-13(5-2-6-14)10-7-9(12)3-4-11(10)15-8;/h3-4,6-8H,2,5H2,1H3;1H/p-1