(4-chlorophenyl)-[4-[2-oxidanyl-3-(4-phenylpyridin-1-ium-1-yl)propyl]sulfanylphenyl]methanone

Systemtic Name: (4-chlorophenyl)-[4-[2-oxidanyl-3-(4-phenylpyridin-1-ium-1-yl)propyl]sulfanylphenyl]methanone Openeye Name: (4-chlorophenyl)-[4-[2-hydroxy-3-(4-phenylpyridin-1-ium-1-yl)propyl]sulfanylphenyl]methanone CAS Name: (4-chlorophenyl)-[4-[[2-hydroxy-3-(4-phenyl-1-pyridin-1-iumyl)propyl]thio]phenyl]methanone IUPAC Name: (4-chlorophenyl)-[4-[2-hydroxy-3-(4-phenylpyridin-1-ium-1-yl)propyl]sulfanylphenyl]methanone Traditional Name: (4-chlorophenyl)-[4-[[2-hydroxy-3-(4-phenylpyridin-1-ium-1-yl)propyl]thio]phenyl]methanone Formula: C27H23ClNO2S+ MolecularWeight: 460.99502

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=[N+](C=C2)CC(CSC3=CC=C(C=C3)C(=O)C4=CC=C(C=C4)Cl)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=[N+](C=C2)CC(CSC3=CC=C(C=C3)C(=O)C4=CC=C(C=C4)Cl)O

InChI

InChI=1S/C27H23ClNO2S/c28-24-10-6-22(7-11-24)27(31)23-8-12-26(13-9-23)32-19-25(30)18-29-16-14-21(15-17-29)20-4-2-1-3-5-20/h1-17,25,30H,18-19H2/q+1