1-phenyl-2-(4,5,6,7-tetrahydro-1,3-benzothiazol-3-ium-3-yl)ethanone

Systemtic Name: 1-phenyl-2-(4,5,6,7-tetrahydro-1,3-benzothiazol-3-ium-3-yl)ethanone Openeye Name: 1-phenyl-2-(4,5,6,7-tetrahydro-1,3-benzothiazol-3-ium-3-yl)ethanone CAS Name: 1-phenyl-2-(4,5,6,7-tetrahydro-1,3-benzothiazol-3-ium-3-yl)ethanone IUPAC Name: 1-phenyl-2-(4,5,6,7-tetrahydro-1,3-benzothiazol-3-ium-3-yl)ethanone Traditional Name: 1-phenyl-2-(4,5,6,7-tetrahydro-1,3-benzothiazol-3-ium-3-yl)ethanone Formula: C15H16NOS+ MolecularWeight: 258.35864

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)[N+](=CS2)CC(=O)C3=CC=CC=C3

Isomeric SMILES

C1CCC2=C(C1)[N+](=CS2)CC(=O)C3=CC=CC=C3

InChI

InChI=1S/C15H16NOS/c17-14(12-6-2-1-3-7-12)10-16-11-18-15-9-5-4-8-13(15)16/h1-3,6-7,11H,4-5,8-10H2/q+1