2-(1,3-benzothiazol-3-ium-3-yl)-1-naphthalen-2-yl-ethanone

Systemtic Name: 2-(1,3-benzothiazol-3-ium-3-yl)-1-naphthalen-2-yl-ethanone Openeye Name: 2-(1,3-benzothiazol-3-ium-3-yl)-1-(2-naphthyl)ethanone CAS Name: 2-(1,3-benzothiazol-3-ium-3-yl)-1-(2-naphthalenyl)ethanone IUPAC Name: 2-(1,3-benzothiazol-3-ium-3-yl)-1-naphthalen-2-ylethanone Traditional Name: 2-(1,3-benzothiazol-3-ium-3-yl)-1-(2-naphthyl)ethanone Formula: C19H14NOS+ MolecularWeight: 304.38556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)C(=O)C[N+]3=CSC4=CC=CC=C43

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)C(=O)C[N+]3=CSC4=CC=CC=C43

InChI

InChI=1S/C19H14NOS/c21-18(12-20-13-22-19-8-4-3-7-17(19)20)16-10-9-14-5-1-2-6-15(14)11-16/h1-11,13H,12H2/q+1