1-(4-methoxyphenyl)-2-pyrylium-4-ylsulfanyl-ethanone bromide

Systemtic Name: 1-(4-methoxyphenyl)-2-pyrylium-4-ylsulfanyl-ethanone bromide Openeye Name: 1-(4-methoxyphenyl)-2-pyrylium-4-ylsulfanyl-ethanone bromide CAS Name: 1-(4-methoxyphenyl)-2-(4-pyryliumylthio)ethanone bromide IUPAC Name: 1-(4-methoxyphenyl)-2-pyrylium-4-ylsulfanylethanone bromide Traditional Name: 1-(4-methoxyphenyl)-2-(pyrylium-4-ylthio)ethanone bromide Formula: C14H13BrO3S MolecularWeight: 341.22022

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)CSC2=CC=[O+]C=C2.[Br-]

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)CSC2=CC=[O+]C=C2.[Br-]

InChI

InChI=1S/C14H13O3S.BrH/c1-16-12-4-2-11(3-5-12)14(15)10-18-13-6-8-17-9-7-13;/h2-9H,10H2,1H3;1H/q+1;/p-1