2-[3-(5-naphthalen-1-yl-1H-pyrazol-3-yl)pyridin-1-ium-1-yl]-1-thiophen-2-yl-ethanone chloride

Systemtic Name: 2-[3-(5-naphthalen-1-yl-1H-pyrazol-3-yl)pyridin-1-ium-1-yl]-1-thiophen-2-yl-ethanone chloride Openeye Name: 2-[3-[5-(1-naphthyl)-1H-pyrazol-3-yl]pyridin-1-ium-1-yl]-1-(2-thienyl)ethanone chloride CAS Name: 2-[3-[5-(1-naphthalenyl)-1H-pyrazol-3-yl]-1-pyridin-1-iumyl]-1-thiophen-2-ylethanone chloride IUPAC Name: 2-[3-(5-naphthalen-1-yl-1H-pyrazol-3-yl)pyridin-1-ium-1-yl]-1-thiophen-2-ylethanone chloride Traditional Name: 2-[3-[5-(1-naphthyl)-1H-pyrazol-3-yl]pyridin-1-ium-1-yl]-1-(2-thienyl)ethanone chloride Formula: C24H18ClN3OS MolecularWeight: 431.93722

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2C3=CC(=NN3)C4=C[N+](=CC=C4)CC(=O)C5=CC=CS5.[Cl-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2C3=CC(=NN3)C4=C[N+](=CC=C4)CC(=O)C5=CC=CS5.[Cl-]

InChI

InChI=1S/C24H18N3OS.ClH/c28-23(24-11-5-13-29-24)16-27-12-4-8-18(15-27)21-14-22(26-25-21)20-10-3-7-17-6-1-2-9-19(17)20;/h1-15H,16H2,(H,25,26);1H/q+1;/p-1