1-(1,3-benzothiazol-2-yl)-2-quinolin-1-ium-1-yl-ethanone bromide

Systemtic Name: 1-(1,3-benzothiazol-2-yl)-2-quinolin-1-ium-1-yl-ethanone bromide Openeye Name: 1-(1,3-benzothiazol-2-yl)-2-quinolin-1-ium-1-yl-ethanone bromide CAS Name: 1-(1,3-benzothiazol-2-yl)-2-(1-quinolin-1-iumyl)ethanone bromide IUPAC Name: 1-(1,3-benzothiazol-2-yl)-2-quinolin-1-ium-1-ylethanone bromide Traditional Name: 1-(1,3-benzothiazol-2-yl)-2-quinolin-1-ium-1-yl-ethanone bromide Formula: C18H13BrN2OS MolecularWeight: 385.27762

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=[N+]2CC(=O)C3=NC4=CC=CC=C4S3.[Br-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=[N+]2CC(=O)C3=NC4=CC=CC=C4S3.[Br-]

InChI

InChI=1S/C18H13N2OS.BrH/c21-16(18-19-14-8-2-4-10-17(14)22-18)12-20-11-5-7-13-6-1-3-9-15(13)20;/h1-11H,12H2;1H/q+1;/p-1