2-(1,3-benzothiazol-3-ium-3-yl)-N,N-bis(prop-2-enyl)ethanamide bromide

Systemtic Name: 2-(1,3-benzothiazol-3-ium-3-yl)-N,N-bis(prop-2-enyl)ethanamide bromide Openeye Name: N,N-diallyl-2-(1,3-benzothiazol-3-ium-3-yl)acetamide bromide CAS Name: 2-(1,3-benzothiazol-3-ium-3-yl)-N,N-bis(prop-2-enyl)acetamide bromide IUPAC Name: 2-(1,3-benzothiazol-3-ium-3-yl)-N,N-bis(prop-2-enyl)acetamide bromide Traditional Name: N,N-diallyl-2-(1,3-benzothiazol-3-ium-3-yl)acetamide bromide Formula: C15H17BrN2OS MolecularWeight: 353.27728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCN(CC=C)C(=O)C[N+]1=CSC2=CC=CC=C21.[Br-]

Isomeric SMILES

C=CCN(CC=C)C(=O)C[N+]1=CSC2=CC=CC=C21.[Br-]

InChI

InChI=1S/C15H17N2OS.BrH/c1-3-9-16(10-4-2)15(18)11-17-12-19-14-8-6-5-7-13(14)17;/h3-8,12H,1-2,9-11H2;1H/q+1;/p-1