2-[2-(6-methoxy-2-oxidanylidene-chromen-3-yl)thiolan-1-ium-1-yl]ethanal bromide

Systemtic Name: 2-[2-(6-methoxy-2-oxidanylidene-chromen-3-yl)thiolan-1-ium-1-yl]ethanal bromide Openeye Name: 2-[2-(6-methoxy-2-oxo-chromen-3-yl)tetrahydrothiophen-1-ium-1-yl]acetaldehyde bromide CAS Name: 2-[2-(6-methoxy-2-oxo-1-benzopyran-3-yl)-1-thiolan-1-iumyl]acetaldehyde bromide IUPAC Name: 2-[2-(6-methoxy-2-oxochromen-3-yl)thiolan-1-ium-1-yl]acetaldehyde bromide Traditional Name: 2-[2-(2-keto-6-methoxy-chromen-3-yl)tetrahydrothiophen-1-ium-1-yl]acetaldehyde bromide Formula: C16H17BrO4S MolecularWeight: 385.27278

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)OC(=O)C(=C2)C3CCC[S+]3CC=O.[Br-]

Isomeric SMILES

COC1=CC2=C(C=C1)OC(=O)C(=C2)C3CCC[S+]3CC=O.[Br-]

InChI

InChI=1S/C16H17O4S.BrH/c1-19-12-4-5-14-11(9-12)10-13(16(18)20-14)15-3-2-7-21(15)8-6-17;/h4-6,9-10,15H,2-3,7-8H2,1H3;1H/q+1;/p-1