2-(1,3-benzothiazol-3-ium-3-yl)-1-(4-phenylphenyl)ethanone

Systemtic Name: 2-(1,3-benzothiazol-3-ium-3-yl)-1-(4-phenylphenyl)ethanone Openeye Name: 2-(1,3-benzothiazol-3-ium-3-yl)-1-(4-phenylphenyl)ethanone CAS Name: 2-(1,3-benzothiazol-3-ium-3-yl)-1-(4-phenylphenyl)ethanone IUPAC Name: 2-(1,3-benzothiazol-3-ium-3-yl)-1-(4-phenylphenyl)ethanone Traditional Name: 2-(1,3-benzothiazol-3-ium-3-yl)-1-(4-phenylphenyl)ethanone Formula: C21H16NOS+ MolecularWeight: 330.42284

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)C[N+]3=CSC4=CC=CC=C43

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)C[N+]3=CSC4=CC=CC=C43

InChI

InChI=1S/C21H16NOS/c23-20(14-22-15-24-21-9-5-4-8-19(21)22)18-12-10-17(11-13-18)16-6-2-1-3-7-16/h1-13,15H,14H2/q+1